SCHEMBL259476

SCHEMBL259476

COc1cccc(-c2nc3cnccc3c(=O)[nH]2)c1

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 6/20 0.66
MAPT P10636 1/20 0.64
NPC1 O15118 1/20 0.53
TNKS O95271 1/20 0.53
GUSB P08236 1/20 0.53
PARP1 P09874 1/20 0.53
CASP3 P42574 1/20 0.53
RAB9A P51151 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
TNKS2 Q9H2K2 1/20 0.53

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
SCHEMBL259622 0.90 KDM4C (0.55) KDM4CMAPTNPC1TNKSGUSB
SCHEMBL259319 0.86 KDM4C (0.60) KDM4CMAPTNPC1RAB9A
SCHEMBL874228 0.85 GUSB (0.73) NPC1TNKSGUSBPARP1CASP3
SCHEMBL29784145 0.85 GUSB (0.73) NPC1TNKSGUSBPARP1CASP3
SCHEMBL14475888 0.84 HPGD (0.59) KDM4CMAPTNPC1TNKSGUSB
SCHEMBL27694110 0.81 NPC1 (0.61) NPC1TNKSGUSBPARP1CASP3
SCHEMBL14475177 0.81 HPGD (0.59) KDM4CMAPTNPC1TNKSGUSB
SCHEMBL9979126 0.81 KDM4C (0.71) KDM4CMAPTNPC1TNKSGUSB
Hydrochloric Acid SCHEMBL7271945 0.81 AURKA (0.57) MAPTNPC1PARP1RAB9A
SCHEMBL14344501 0.80 KDM4C (1.00) KDM4CMAPTNPC1TNKSGUSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067586-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2011-11-29 US disclosed
US-8067586-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2011-11-29 US disclosed
US-20100137584-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20100137584-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20100137585-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20100137585-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 US disclosed
US-20070037805-A1 Fused heteroaryl derivatives HAYAKAWA MASAHIKO 2007-02-15 US disclosed
US-20070037805-A1 Fused heteroaryl derivatives HAYAKAWA MASAHIKO 2007-02-15 US disclosed
US-7173029-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2007-02-06 US disclosed
US-7173029-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2007-02-06 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-20100137584-A1 FUSED HETEROARYL DERIVATIVES PIK3CD, PIK3R3, PIK3C2A KDM4C 2570/4885MAPT 3923/4885NPC1 1963/4885
US-20070037805-A1 Fused heteroaryl derivatives PIK3CD, PIK3R3, PIK3C2A KDM4C 2570/4885MAPT 3923/4885NPC1 1963/4885
US-20100137585-A1 FUSED HETEROARYL DERIVATIVES PIK3CD, PIK3R3, PIK3C2A KDM4C 2570/4885MAPT 3923/4885NPC1 1963/4885

“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.