SCHEMBL31745554

SCHEMBL31745554

CNc1nccn2c(Br)c(-c3ccc(Oc4cccc(C)n4)cc3)c(C(N)=O)c12

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TNK2 Q07912 9/20 0.37
▸ ADAMTS4 O75173 1/20 0.35
▸ MAP4K2 Q12851 2/20 0.34
▸ GRM5 P41594 1/20 0.34
▸ FPR2 P25090 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ BTK Q06187 1/20 0.33
▸ SYK P43405 1/20 0.33
▸ ZAP70 P43403 2/20 0.33
▸ KARS1 Q15046 2/20 0.33
▸ FFAR1 O14842 1/20 0.33
▸ TSHR P16473 1/20 0.32

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
SCHEMBL31745561 0.83 TNK2 (0.35) TNK2ADAMTS4BTK
SCHEMBL31745508 0.82 MAP2K7 (0.42) BTKSYKZAP70
SCHEMBL31360346 0.81 BTK (0.38) GRM5BTKSYK
SCHEMBL31745524 0.72 TNK2 (0.36) TNK2BTK
SCHEMBL29002666 0.71 PARP1 (0.39) ADAMTS4GRM5FPR2SCN9ASYK
SCHEMBL31745551 0.70 BTK (0.38) GRM5BTK
SCHEMBL31745492 0.69 GRM5 (0.36) ADAMTS4GRM5BTK
SCHEMBL29002670 0.68 MAP2 (0.37) ADAMTS4GRM5FPR2SCN9ASYK
SCHEMBL25715990 0.68 TNK2 (0.51) TNK2BTK
SCHEMBL31745504 0.67 BTK (0.34) TNK2ADAMTS4GRM5BTKSYK

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-20250382297-A1 INHIBITORS OF FGFR2 AND FGFR3 AND USES THEREOF INSILICO MEDICINE IP LTD (HK) 2025-12-18 — — 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-20250382297-A1 INHIBITORS OF FGFR2 AND FGFR3 AND USES THEREOF FGFR3, FGFR2, FGFR1 TNK2 452/4885ADAMTS4 1032/4885MAP4K2 606/4885

“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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