SCHEMBL3024916

SCHEMBL3024916

Cc1ccc(C(=O)Sc2ccccn2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.61
RAB9A P51151 6/20 0.61
ALDH1A1 P00352 4/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
KDM4E B2RXH2 2/20 0.61
HPGD P15428 2/20 0.61
HSD17B10 Q99714 2/20 0.61
ALOX15 P16050 1/20 0.61
POLB P06746 2/20 0.51
HSP90AA1 P07900 1/20 0.51
KMT2A Q03164 5/20 0.50
MEN1 O00255 2/20 0.50
MAPT P10636 3/20 0.45
LMNA P02545 1/20 0.44
PKM P14618 1/20 0.43
CDK5 Q00535 1/20 0.43
PAX8 Q06710 1/20 0.43
CDK5R1 Q15078 1/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4483430 0.86 ALDH1A1 (0.54) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL10126446 0.85 POLB (0.45) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL6937212 0.83 TLR7 (0.49) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL5089864 0.83 KMT2A (0.46) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL2259597 0.83 POLB (0.55) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL17662589 0.83 NPC1 (0.45) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL6420708 0.83 MAPT (0.59) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL3822586 0.80 CA1 (0.46) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL6511271 0.80 POLB (0.41) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E
SCHEMBL16629710 0.80 ALDH1A1 (0.43) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 75 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9417245-B2 Porphyrinic compounds for use in flow cytometry NORTH CAROLINA STATE UNIVERSITY (US) 2016-08-16 US disclosed
US-9417245-B2 Porphyrinic compounds for use in flow cytometry NORTH CAROLINA STATE UNIVERSITY (US) 2016-08-16 US disclosed
US-20150153350-A1 PORPHYRINIC COMPOUNDS FOR USE IN FLOW CYTOMETRY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-06-04 US disclosed
US-20150153350-A1 PORPHYRINIC COMPOUNDS FOR USE IN FLOW CYTOMETRY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-06-04 US disclosed
US-8980565-B2 Porphyrinic compounds for use in flow cytometry NORTH CAROLINA STATE UNIVERSITY (US) 2015-03-17 US disclosed
US-8980565-B2 Porphyrinic compounds for use in flow cytometry NORTH CAROLINA STATE UNIVERSITY (US) 2015-03-17 US disclosed
US-8546088-B2 Porphyrinic compounds for use in flow cytometry NORTH CAROLINA STATE UNIVERSITY (US) 2013-10-01 US disclosed
US-8546088-B2 Porphyrinic compounds for use in flow cytometry NORTH CAROLINA STATE UNIVERSITY (US) 2013-10-01 US disclosed
US-8445695-B2 Synthesis of phosphono-substituted porphyrin compounds for attachment to metal oxide surfaces NORTH CAROLINA STATE UNIVERSITY (US) 2013-05-21 US disclosed
US-8420804-B2 Formyl- and acetal-porphyrins bearing tripodal linking groups NORTH CAROLINA STATE UNIVERSITY (US) 2013-04-16 US disclosed
US-7153975-B2 Boron complexation strategy for use in manipulating 1-acyldipyrromethanes NORTH CAROLINA STATE UNIVERSITY (US) 2006-12-26 US disclosed
US-20050282778-A1 Boron complexation strategy for use in manipulating 1-acyldipyrromethanes NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-12-22 US disclosed
US-20050282779-A1 Boron complexation strategy for use in manipulating 1-acyldipyrromethanes NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-12-22 US disclosed
US-6946552-B2 Refined routes to chlorin building blocks NORTH CAROLINA STATE UNIVERSITY (US) 2005-09-20 US disclosed
US-20050165228-A1 Refined routes to chlorin building blocks NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-07-28 US disclosed
US-6728129-B2 Multistate triple-decker dyads in three distinct architectures for information storage applications THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-04-27 US disclosed
US-20030169618-A1 Multistate triple-decker dyads in three distinct architectures for information storage applications THE REGENTS OF THE UNIVERSITY OF CALIFORNIA OFFICE OF TECHNOLOGY TRANSFER 2003-09-11 US disclosed
WO-2003071552-A1 MULTISTATE TRIPLE-DECKER DYADS IN THREE DISTINCT ARCHITECTURES FOR INFORMATION STORAGE APPLICATIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2003-08-28 WO disclosed
US-20030096989-A1 Refined routes to chlorin building blocks NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-05-22 US disclosed
WO-2002092601-A1 REFINED ROUTES TO CHLORIN BUILDING BLOCKS NORTH CAROLINA STATE UNIVERSITY (US) 2002-11-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050282778-A1 Boron complexation strategy for use in manipulating 1-acyldipyrromethanes DECR2, ANTXR2, CD79B NPC1 3425/4885RAB9A 2735/4885ALDH1A1 2207/4885
US-20050282779-A1 Boron complexation strategy for use in manipulating 1-acyldipyrromethanes DECR2, ANTXR2, CD79B NPC1 3425/4885RAB9A 2735/4885ALDH1A1 2207/4885
US-20050165228-A1 Refined routes to chlorin building blocks DHFR, DDT, SHARPIN NPC1 3982/4885RAB9A 4284/4885ALDH1A1 3657/4885
US-20030096989-A1 Refined routes to chlorin building blocks DHFR, DDT, SHARPIN NPC1 3982/4885RAB9A 4284/4885ALDH1A1 3657/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.