SCHEMBL31035975

SCHEMBL31035975

CCC(=O)NCCOCCCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.53
TRPV1 Q8NER1 1/20 0.52
HPGD P15428 3/20 0.52
ALDH1A1 P00352 1/20 0.52
KMT2A Q03164 1/20 0.52
GAA P10253 1/20 0.51
MTNR1A P48039 4/20 0.51
MTNR1B P49286 4/20 0.51
LMNA P02545 2/20 0.51
KDM4E B2RXH2 1/20 0.51
TSHR P16473 1/20 0.50

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
SCHEMBL4773573 0.87 RECQL (0.57) RECQLL3MBTL1TRPV1HPGDALDH1A1
SCHEMBL3919664 0.85 TRPV1 (0.71) RECQLL3MBTL1TRPV1HPGDALDH1A1
SCHEMBL31035980 0.83 TRPV1 (0.73) RECQLL3MBTL1TRPV1HPGDALDH1A1
SCHEMBL31036003 0.83 TRPV1 (0.73) RECQLL3MBTL1TRPV1HPGDALDH1A1
SCHEMBL31035861 0.83 TRPV1 (0.73) RECQLL3MBTL1TRPV1HPGDALDH1A1
SCHEMBL7598872 0.83 L3MBTL1 (0.74) RECQLL3MBTL1TRPV1HPGDALDH1A1
SCHEMBL154367 0.80 MTNR1A (0.73) L3MBTL1HPGDALDH1A1MTNR1AMTNR1B
Benzene SCHEMBL29176463 0.80 MTNR1A (0.73) L3MBTL1HPGDALDH1A1MTNR1AMTNR1B
SCHEMBL553140 0.78 PLAAT3 (0.50) L3MBTL1ALDH1A1KMT2ALMNAKDM4E
SCHEMBL25139566 0.78 L3MBTL1 (0.66) RECQLL3MBTL1TRPV1HPGDALDH1A1

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
CN-118255685-A Tricyclic compound, pharmaceutical composition and application thereof 珂阑(上海)医药科技有限公司 2024-06-28 CN disclosed