SCHEMBL13047049

SCHEMBL13047049

Cc1cccc(C(=O)Nc2cccc3c(=O)n(CC(C)(C)C)ccc23)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
GPR35 Q9HC97 1/20 0.46
MAPT P10636 2/20 0.46
POLB P06746 2/20 0.46
CNR2 P34972 1/20 0.45
KCNK3 O14649 4/20 0.43
KCNK9 Q9NPC2 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KCNH2 Q12809 1/20 0.43
LMNA P02545 4/20 0.43
CCR8 P51685 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
NLRP3 Q96P20 1/20 0.41

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
SCHEMBL13047125 0.86 MEN1 (0.42) KMT2AMEN1MAPTRAB9ALMNA
SCHEMBL13046666 0.85 TAS1R3 (0.46) KMT2AMAPTPOLBCNR2LMNA
SCHEMBL13047109 0.85 NPC1 (0.47) KMT2AMEN1MAPTPOLBCNR2
SCHEMBL13047447 0.85 POLB (0.45) KMT2AMEN1MAPTPOLBCNR2
SCHEMBL13047059 0.85 NPC1 (0.49) KMT2AMEN1GPR35MAPTCNR2
SCHEMBL13046662 0.85 KMT2A (0.49) KMT2AMEN1MAPTPOLBNPC1
SCHEMBL13047451 0.84 RAB9A (0.53) KMT2AMEN1MAPTPOLBKCNK9
SCHEMBL13047509 0.84 RXFP1 (0.55) KMT2AMEN1GPR35MAPTPOLB
SCHEMBL1590420 0.84 KMT2A (0.51) KMT2AMEN1GPR35MAPTPOLB
SCHEMBL13047462 0.84 MEN1 (0.47) KMT2AMEN1MAPTCNR2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546579-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof EVOTEC (US) INC. (US) 2013-10-01 US disclosed
US-8546579-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof EVOTEC (US) INC. (US) 2013-10-01 US disclosed
US-20100292235-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof SECOND GENOME, INC. 2010-11-18 US disclosed
US-20100292235-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof SECOND GENOME, INC. 2010-11-18 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 (1 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-20100292235-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX2 KMT2A 4614/4885MEN1 4853/4885GPR35 73/4885

“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.