SCHEMBL31327764

SCHEMBL31327764

FC(F)c1cc(Cl)c2cc(Cl)ccc2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ NT5E P21589 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ ACHE P22303 4/20 0.38
▸ BCHE P06276 3/20 0.38
▸ GRIN1 Q05586 3/20 0.38
▸ GRIN2A Q12879 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ HPGD P15428 2/20 0.37
▸ PTGES O14684 1/20 0.37
▸ ALOX5 P09917 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MEN1 O00255 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
SCHEMBL29632453 0.81 MAOA (0.45) MAPK1ALDH1A1ACHEKDM4EHPGD
SCHEMBL29799170 0.76 LMNA (0.46) MAPK1NPC1RAB9ALMNAHTT
SCHEMBL2535170 0.76 LMNA (0.46) MAPK1NPC1RAB9ALMNAHTT
SCHEMBL2709700 0.74 NT5E (0.70) MAPK1NPC1RAB9ALMNAHTT
SCHEMBL30492143 0.74 NT5E (0.70) MAPK1NPC1RAB9ALMNAHTT
SCHEMBL3648083 0.73 LMNA (0.72) LMNAHTTALDH1A1MEN1KMT2A
SCHEMBL28130492 0.73 NT5E (0.46) MAPK1NPC1RAB9ALMNAHTT
SCHEMBL19150086 0.73 POLB (0.43) ALDH1A1ACHEBCHEMEN1KMT2A
SCHEMBL31327775 0.71 NT5E (0.53) MAPK1NPC1RAB9ALMNAHTT
SCHEMBL9493144 0.70 NT5E (0.51) MAPK1LMNAHTTNT5EALDH1A1

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-20250084063-A1 BICYCLIC HETEROCYCLES AS MRGPRX2 ANTAGONISTS INCYTE CORPORATION 2025-03-13 — — US disclosed
WO-2025042736-A1 BICYCLIC HETEROCYCLES AS MRGPRX2 ANTAGONISTS INCYTE CORPORATION (US) 2025-02-27 — — WO 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-20250084063-A1 BICYCLIC HETEROCYCLES AS MRGPRX2 ANTAGONISTS MRGPRX2, MRGPRX1, MRGPRX4 MAPK1 1493/4885NPC1 547/4885RAB9A 1605/4885

“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.

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