SCHEMBL2993250

SCHEMBL2993250

c1ccc(-c2cc(-c3cc4c5ccccc5ccc4n3-c3ccccc3)on2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.47
RAB9A P51151 8/20 0.47
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
GRM5 P41594 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
CYP1A2 P05177 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
NFKB1 P19838 1/20 0.40
CYP2C19 P33261 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
MAOB P27338 1/20 0.39
MAPT P10636 1/20 0.39
HPGDS O60760 1/20 0.39

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
SCHEMBL2981842 0.88 TSHR (0.42) NPC1RAB9AMEN1KMT2AGRM5
SCHEMBL12076675 0.83 CYP1A2 (0.47) NPC1RAB9ACASP3SENP7SENP6
SCHEMBL2992434 0.81 HPGD (0.38) NPC1RAB9AMEN1KMT2ACASP3
SCHEMBL2985650 0.75 PTGS2 (0.48) KMT2AMAPTPTGS2KDM4E
SCHEMBL22214581 0.75 MAPT (0.38) NPC1RAB9ASMN1; SMN2HPGDNFKB1
SCHEMBL16005725 0.74 ALDH1A1 (0.41) NPC1RAB9AMEN1KMT2ACYP1A2
SCHEMBL2994740 0.73 FDPS (0.40) NPC1RAB9AMEN1KMT2ACYP1A2
SCHEMBL4148824 0.72 EGFR (0.46) RAB9AMEN1KMT2ACYP1A2CYP2C19
SCHEMBL2987944 0.72 KDM4E (0.45) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL4140780 0.71 ALDH1A1 (0.43) MEN1KMT2ACYP1A2HPGDMAPT

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1809601-B1 COMPOUNDS FOR ALZHEIMER'S DISEASE MANFREDI JOHN (US) 2014-09-10 EP claimed
US-9216966-B2 Compounds for Alzheimer's disease Manfredi, John (US) 2015-12-22 US disclosed
US-9034871-B2 Compounds for Alzheimer's disease Manfredi, John (US) 2015-05-19 US disclosed
EP-1809601-B1 COMPOUNDS FOR ALZHEIMER'S DISEASE MANFREDI JOHN (US) 2014-09-10 EP disclosed
US-20130261118-A1 COMPOUNDS FOR ALZHEIMER'S DISEASE MANFREDI JOHN (US) 2013-10-03 US disclosed
US-20120225873-A1 COMPOUNDS FOR ALZHEIMER'S DISEASE MYREXIS, INC. (US) 2012-09-06 US disclosed
US-20100184975-A1 COMPOUNDS FOR ALZHEIMBER'S DISEASE MYRIAD PHARMACEUTICALS, INC. (US) 2010-07-22 US disclosed
US-7678823-B2 N-phenylindoles; oral dosage forms; side effect reduction Myriad Pharmaceticals, Inc. (US) 2010-03-16 US disclosed
US-20080249135-A1 N-phenylindoles; oral dosage forms; side effect reduction MYRIAD GENETICS, INCORPORATED (US) 2008-10-09 US 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-20130261118-A1 COMPOUNDS FOR ALZHEIMER'S DISEASE SLC18A2, SLC18A3, NLN NPC1 26/4885RAB9A 446/4885MEN1 3980/4885
US-20080249135-A1 N-phenylindoles; oral dosage forms; side effect reduction NCL, PSEN2, CCNO NPC1 138/4885RAB9A 3156/4885MEN1 3473/4885
US-20100184975-A1 COMPOUNDS FOR ALZHEIMBER'S DISEASE PSEN2, PSEN1, CLN6 NPC1 412/4885RAB9A 3991/4885MEN1 4030/4885
US-20120225873-A1 COMPOUNDS FOR ALZHEIMER'S DISEASE PSEN2, CHAT, PSEN1 NPC1 504/4885RAB9A 3015/4885MEN1 4551/4885

“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.