SCHEMBL4993377

SCHEMBL4993377

NC(=O)c1n[c]c2c(n1)CN(S(=O)(=O)c1ccc(Cl)cc1)CC2

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
MAPT P10636 1/20 0.40
AKR1C3 P42330 4/20 0.39
AKR1C1 Q04828 1/20 0.39
POLB P06746 2/20 0.39
LMNA P02545 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
PKM P14618 1/20 0.38
CNR1 P21554 1/20 0.38
IKBKB O14920 1/20 0.38
CHUK O15111 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ATM Q13315 1/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL4988448 0.90 MEN1 (0.45) KMT2AAKR1C3AKR1C1PKM
SCHEMBL4988327 0.89 GBA1 (0.48) KMT2ALMNAPKM
SCHEMBL4983020 0.89 MEN1 (0.47) KMT2AAKR1C3POLBL3MBTL1PKM
SCHEMBL4986140 0.89 CNR1 (0.38) MAPTAKR1C3AKR1C1CNR1TP53
SCHEMBL4992564 0.88 MEN1 (0.47) KMT2AMAPTAKR1C3AKR1C1LMNA
SCHEMBL4988779 0.87 TDP1 (0.45) KMT2AMAPTAKR1C3AKR1C1L3MBTL1
SCHEMBL4988642 0.87 MAPT (0.43) KMT2AMAPTAKR1C3AKR1C1LMNA
SCHEMBL4987925 0.86 HDAC6 (0.44) KMT2AAKR1C3L3MBTL1ATM
SCHEMBL4987011 0.86 PKM (0.46) KMT2AMAPTLMNAL3MBTL1PKM
SCHEMBL4980960 0.85 SMN1; SMN2 (0.46) KMT2AMAPTAKR1C3LMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof RENOVIS, INC. 2008-02-14 US claimed
US-7297700-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2007-11-20 US claimed

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX2 KMT2A 4614/4885MAPT 4477/4885AKR1C3 1419/4885

“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.