SCHEMBL4989423

SCHEMBL4989423

Nc1ncnc2c1CCN(S(=O)(=O)Cc1cccc(C(F)(F)F)c1)C2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR142 Q7Z601 1/20 0.47
GPR52 Q9Y2T5 7/20 0.41
SCN9A Q15858 4/20 0.40
TRPV1 Q8NER1 1/20 0.38
GALR3 O60755 1/20 0.38
AKR1B1 P15121 1/20 0.38
RIPK1 Q13546 2/20 0.37
NTRK1 P04629 1/20 0.37
CYP1A2 P05177 1/20 0.37
LCK P06239 1/20 0.37
YES1 P07947 1/20 0.37
RET P07949 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C8 P10632 1/20 0.37
CYP2D6 P10635 1/20 0.37
KIT P10721 1/20 0.37
CYP2C9 P11712 1/20 0.37
EIF2AK2 P19525 1/20 0.37
AXL P30530 1/20 0.37
CYP2C19 P33261 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
SCHEMBL4986769 0.89 SCN9A (0.40) GPR142GPR52SCN9ATRPV1
SCHEMBL4988794 0.84 TSHR (0.47)
SCHEMBL4987060 0.82 HTT (0.48) SCN9ACYP1A2CYP2C19
SCHEMBL4985989 0.81 KDM4E (0.50) GPR52TRPV1CYP3A4
SCHEMBL4988108 0.81 GPR183 (0.36)
SCHEMBL4983580 0.80 LPAR1 (0.39) CYP3A4
SCHEMBL4982513 0.78 L3MBTL1 (0.46)
SCHEMBL5142651 0.78 CNR2 (0.37) CYP2C19
SCHEMBL13532364 0.78 GPR142 (0.39) GPR142GPR52SCN9ATRPV1GALR3
SCHEMBL14272412 0.77 TSHR (0.47) GPR142GPR52SCN9ATRPV1

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 GPR142 244/4885GPR52 124/4885SCN9A 2164/4885

“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.