SCHEMBL25002969

SCHEMBL25002969

COc1cc(/C=N/NC(=O)c2ccnc(-c3ccc(Cl)cc3)c2)cc(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 1/20 0.52
▸ POLB P06746 4/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ HPGD P15428 5/20 0.49
▸ ALDH1A1 P00352 5/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ MAPT P10636 5/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ PSMD14 O00487 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ KDM1A O60341 2/20 0.45
▸ HDAC1 Q13547 2/20 0.45
▸ HDAC6 Q9UBN7 2/20 0.45
▸ SCN2A Q99250 1/20 0.45
▸ SCN10A Q9Y5Y9 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ RAB9A P51151 1/20 0.45

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
SCHEMBL30950965 1.00 MGAM (0.52) MGAMPOLBKMT2AHPGDALDH1A1
SCHEMBL27237429 1.00 MGAM (0.52) MGAMPOLBKMT2AHPGDALDH1A1
SCHEMBL27237474 0.93 MGAM (0.55) MGAMPOLBKMT2AHPGDALDH1A1
SCHEMBL25003149 0.93 MGAM (0.55) MGAMPOLBKMT2AHPGDALDH1A1
SCHEMBL25002971 0.88 POLB (0.53) MGAMPOLBKMT2AHPGDALDH1A1
SCHEMBL27237375 0.88 POLB (0.53) MGAMPOLBKMT2AHPGDALDH1A1
SCHEMBL25002962 0.87 MGAM (0.50) MGAMPOLBKMT2AHPGDALDH1A1
SCHEMBL27237416 0.87 MGAM (0.50) MGAMPOLBKMT2AHPGDALDH1A1
SCHEMBL25003150 0.86 POLB (0.55) MGAMPOLBKMT2AHPGDALDH1A1
SCHEMBL30171327 0.86 POLB (0.50) MGAMPOLBKMT2AHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4382101-A1 N-ACYLHYDRAZONE COMPOUNDS CAPABLE OF INHIBITING NAV1.7 AND/OR NAV1.8, PROCESSES FOR THE PREPARATION THEREOF, COMPOSITIONS, USES, METHODS FOR TREATMENT USING SAME, AND KITS Eurofarma Laboratórios S.A. (BR) 2024-06-12 — — EP claimed
CN-118076347-A N-acylhydrazone compounds capable of inhibiting NAV 1.7 and/or NAV 1.8, methods of making, compositions, uses, methods of treatment and kits using the same 欧罗法玛实验室股份公司 2024-05-24 — — CN claimed
EP-4382101-A1 N-ACYLHYDRAZONE COMPOUNDS CAPABLE OF INHIBITING NAV1.7 AND/OR NAV1.8, PROCESSES FOR THE PREPARATION THEREOF, COMPOSITIONS, USES, METHODS FOR TREATMENT USING SAME, AND KITS Eurofarma Laboratórios S.A. (BR) 2024-06-12 — — EP disclosed
CN-118076347-A N-acylhydrazone compounds capable of inhibiting NAV 1.7 and/or NAV 1.8, methods of making, compositions, uses, methods of treatment and kits using the same 欧罗法玛实验室股份公司 2024-05-24 — — CN disclosed
WO-2023010192-A1 N-ACYLHYDRAZONE COMPOUNDS CAPABLE OF INHIBITING NAV1.7 AND/OR NAV1.8, PROCESSES FOR THE PREPARATION THEREOF, COMPOSITIONS, USES, METHODS FOR TREATMENT USING SAME, AND KITS EUROFARMA LABORATÓRIOS S.A. (BR) 2023-02-09 — — WO disclosed
Send feedback