SCHEMBL3927660

SCHEMBL3927660

Oc1cc(Nc2cccnc2)cc(-c2cccc3c2CCC3)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 2/20 0.39
KIF11 P52732 1/20 0.37
CYP11B1 P15538 5/20 0.37
CYP11B2 P19099 5/20 0.37
SRC P12931 2/20 0.36
PIK3CA P42336 1/20 0.36
PDGFRB P09619 1/20 0.36
CYP19A1 P11511 2/20 0.35
ALDH1A1 P00352 2/20 0.35
NLRP3 Q96P20 1/20 0.34
NPY5R Q15761 1/20 0.34
EGFR P00533 1/20 0.34
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33

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
SCHEMBL3924503 0.80 CYP11B1 (0.53) L3MBTL1NPC1RAB9AKDM4EMAPT
SCHEMBL3936784 0.76 PIP4K2A (0.47) L3MBTL1NPC1RAB9AKDM4EMAPT
SCHEMBL3937644 0.76 NPC1 (0.49) L3MBTL1NPC1RAB9AKDM4EMAPT
SCHEMBL3938396 0.75 L3MBTL1 (0.60) L3MBTL1NPC1RAB9AKDM4EMAPT
SCHEMBL23640835 0.74 CYP11B1 (0.56) CYP11B1CYP11B2CYP19A1ALDH1A1NPY5R
SCHEMBL3933856 0.74 NPC1 (0.41) L3MBTL1NPC1RAB9AKDM4EMAPT
SCHEMBL3926887 0.73 NPC1 (0.49) L3MBTL1NPC1RAB9AKDM4EMAPT
SCHEMBL4778406 0.73 KDM4E (0.41) L3MBTL1NPC1RAB9AKDM4EMAPT
SCHEMBL3925498 0.73 KIF11 (0.48) L3MBTL1NPC1RAB9AKDM4EMAPT
SCHEMBL3925320 0.73 KDR (0.47) L3MBTL1NPC1RAB9AKDM4EMAPT

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
US-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2009-04-09 US claimed
US-20080280891-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2008-11-13 US claimed
WO-2008008059-A1 ANTI-CANCER AGENTS ANS USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2008-01-17 WO claimed
US-20060270686-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. 2006-11-30 US claimed
US-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2009-04-09 US disclosed
US-7504401-B2 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2009-03-17 US disclosed
US-20080280891-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2008-11-13 US disclosed
WO-2008008059-A1 ANTI-CANCER AGENTS ANS USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2008-01-17 WO disclosed
US-20060270686-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. 2006-11-30 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 (3 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-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MCL1, CBR3 L3MBTL1 385/4885NPC1 2440/4885RAB9A 2506/4885
US-20060270686-A1 Anti-cancer agents and uses thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MCL1, CBR3 L3MBTL1 415/4885NPC1 2367/4885RAB9A 2544/4885
US-20080280891-A1 Anti-cancer agents and uses thereof NR2E3, RB1, CBR3 L3MBTL1 344/4885NPC1 1074/4885RAB9A 2858/4885

“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.