SCHEMBL31401477

SCHEMBL31401477

O=C(C1CC1)N1CC=C(c2cccc(Br)n2)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 5/20 0.51
JAK2 O60674 2/20 0.51
TYK2 P29597 1/20 0.51
ALDH1A1 P00352 5/20 0.45
ALOX15 P16050 3/20 0.45
TSHR P16473 2/20 0.45
MAPK1 P28482 1/20 0.45
NAMPT P43490 9/20 0.44
GAA P10253 2/20 0.43
USP2 O75604 2/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 1/20 0.42
JAK3 P52333 1/20 0.41
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL439379 0.84 ALDH1A1 (0.41) ALDH1A1ALOX15TSHRNAMPTGAA
SCHEMBL5337565 0.77 GRM1 (0.58) JAK1NAMPT
SCHEMBL31401167 0.76 MEN1 (0.45) JAK1ALDH1A1ALOX15TSHRNAMPT
SCHEMBL171408 0.75 GRM5 (0.50) ALDH1A1ALOX15GAASMN1; SMN2MAPT
SCHEMBL31401537 0.73 JAK1 (0.41) JAK1JAK2TYK2ALDH1A1ALOX15
SCHEMBL5348848 0.73 QDPR (0.45) ALOX15KDM4E
SCHEMBL10255367 0.69 ALDH1A1 (0.45) JAK1JAK2TYK2ALDH1A1ALOX15
SCHEMBL20597915 0.69 ALDH1A1 (0.46) JAK1JAK2TYK2ALDH1A1ALOX15
SCHEMBL14761667 0.69 ALDH1A1 (0.42) ALDH1A1ALOX15TSHRGAAKDM4E
SCHEMBL29668566 0.69 ALDH1A1 (0.41) ALDH1A1ALOX15TSHRNAMPTGAA

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
EP-4739682-A1 1,6-NAPHTHRIDINE COMPOUNDS AS SMARCA2 INHIBITORS USEFUL FOR THE TREATMENT OF SMARCA4 DEFICIENT CANCERS Janssen Pharmaceutica NV (BE) 2026-05-13 EP disclosed
WO-2025008058-A1 1,6-NAPHTHRIDINE COMPOUNDS AS SMARCA2 INHIBITORS USEFUL FOR THE TREATMENT OF SMARCA4 DEFICIENT CANCERS JANSSEN PHARMACEUTICA NV (BE) 2025-01-09 WO disclosed