SCHEMBL30620401

SCHEMBL30620401

CC(=O)Sc1nnnn1-c1ccc(C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.53
▸ HTT P42858 4/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ TSHR P16473 2/20 0.53
▸ RECQL P46063 1/20 0.53
▸ ESR2 Q92731 1/20 0.53
▸ ALPL P05186 1/20 0.52
▸ ALPG P10696 1/20 0.52
▸ ALDH1A1 P00352 7/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ HPGD P15428 2/20 0.49
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ PTGS2 P35354 2/20 0.47
▸ ALOX12 P18054 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ NTRK1 P04629 1/20 0.46

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
SCHEMBL10951363 0.86 ALDH1A1 (0.67) LMNAHTTKMT2AMEN1TSHR
SCHEMBL11022928 0.84 ALDH1A1 (0.65) LMNAHTTKMT2AMEN1TSHR
SCHEMBL11809621 0.82 ALDH1A1 (0.46) LMNAHTTKMT2AMEN1TSHR
SCHEMBL14606081 0.81 KMT2A (0.65) LMNAHTTKMT2AMEN1TSHR
SCHEMBL12161303 0.78 MEN1 (0.62) LMNAHTTKMT2AMEN1TSHR
SCHEMBL1610173 0.78 POLB (0.76) LMNAHTTKMT2AMEN1TSHR
SCHEMBL27895613 0.74 SMN1; SMN2 (0.63) LMNAHTTKMT2AMEN1TSHR
SCHEMBL17153750 0.73 ALDH1A1 (0.57) LMNAHTTKMT2AMEN1TSHR
SCHEMBL30620393 0.73 ALDH1A1 (0.56) LMNAHTTKMT2AMEN1TSHR
SCHEMBL3748699 0.72 ALDH1A1 (0.65) LMNAHTTKMT2AMEN1TSHR

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-4508038-A1 COMPOSITIONS AND METHODS FOR INHIBITING CARP-1 BINDING TO NEMO The United States Government as represented by the Department of Veterans Affairs (US) 2025-02-19 — — EP disclosed
WO-2023201374-A1 COMPOSITIONS AND METHODS FOR INHIBITING CARP-1 BINDING TO NEMO THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS (US) 2023-10-19 — — WO disclosed
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