SCHEMBL4986273

SCHEMBL4986273

NC(=O)c1n[c]c2c(n1)CN(S(=O)(=O)c1cc(F)ccc1F)CC2

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.42
POLB P06746 2/20 0.41
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.37
KMT2A Q03164 1/20 0.37
TP53 P04637 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 5/20 0.35
LMNA P02545 1/20 0.35
AKR1C3 P42330 2/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTR6 P50406 1/20 0.34
RECQL P46063 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
SCHEMBL4989380 0.92 ALDH1A1 (0.39) PKML3MBTL1KMT2AMAPTAKR1C3
SCHEMBL4989326 0.91 ALDH1A1 (0.38) PKMPOLBL3MBTL1KMT2ATP53
SCHEMBL4988235 0.90 MAPT (0.38) POLBRAB9AKMT2ATP53SMN1; SMN2
SCHEMBL4988076 0.89 KMT2A (0.49) PKMPOLBRAB9AL3MBTL1KMT2A
SCHEMBL4991400 0.88 EPHX2 (0.41) RAB9ATP53SMN1; SMN2LMNAAKR1C3
SCHEMBL4989307 0.86 ALDH1A1 (0.46) PKMPOLBRAB9AL3MBTL1KMT2A
SCHEMBL4983020 0.85 MEN1 (0.47) PKMPOLBL3MBTL1KMT2AAKR1C3
SCHEMBL4986102 0.83 PKM (0.44) PKMPOLBL3MBTL1KMT2AAKR1C3
SCHEMBL4992564 0.82 MEN1 (0.47) PKML3MBTL1KMT2ATP53MAPT
SCHEMBL4986058 0.82 USP2 (0.46) PKMPOLBL3MBTL1KMT2ASMN1; SMN2

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 PKM 1098/4885POLB 3676/4885NPC1 2233/4885

“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.