SCHEMBL31532265

SCHEMBL31532265

FC(F)(F)c1cnc(-c2ccc3c(c2)CNC3)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ASIC3 Q9UHC3 3/20 0.47
▸ S1PR1 P21453 2/20 0.39
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ TDP2 O95551 1/20 0.35
▸ HDAC4 P56524 2/20 0.35
▸ PNMT P11086 3/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ HDAC3 O15379 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC7 Q8WUI4 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ HDAC9 Q9UKV0 1/20 0.34
▸ HDAC5 Q9UQL6 1/20 0.34
▸ NCOR2 Q9Y618 1/20 0.34

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
SCHEMBL29835145 0.74 PNMT (0.56) ASIC3TDP2PNMT
SCHEMBL2310562 0.74 PNMT (0.56) ASIC3TDP2PNMT
Hydrochloric Acid SCHEMBL29627981 0.72 PNMT (0.54) ASIC3MAPTTDP2PNMT
Bromide SCHEMBL2310632 0.72 PNMT (0.54) ASIC3TDP2PNMT
Hydrochloric Acid SCHEMBL1647036 0.72 PNMT (0.54) ASIC3MAPTTDP2PNMT
SCHEMBL30637812 0.71 MAOB (0.32) NPC1RAB9AALDH1A1MAPTHTT
Bromide SCHEMBL2310627 0.71 PNMT (0.53) ASIC3TDP2PNMT
SCHEMBL20374025 0.70 USP30 (0.46) ASIC3
SCHEMBL21598649 0.69 CYP1A2 (0.39) ASIC3S1PR1
SCHEMBL621045 0.68 ALDH1A1 (0.34) ASIC3RAB9AALDH1A1MAPTPNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250100998-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. 2025-03-27 — — 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-20250100998-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 ASIC3 2870/4885S1PR1 1549/4885NPC1 2431/4885

“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.

Send feedback