SCHEMBL11515258

SCHEMBL11515258

CCCCCCCCCCCCCCCCCC(CC(N)=O)Sc1nnnn1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.53
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ TP53 P04637 1/20 0.48
▸ POLB P06746 4/20 0.46
▸ MAPT P10636 1/20 0.46
▸ MAPK1 P28482 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ LMNA P02545 3/20 0.43
▸ HTT P42858 2/20 0.43
▸ RECQL P46063 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ HPGD P15428 1/20 0.42

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
SCHEMBL11529004 0.81 ALDH1A1 (0.55) ALDH1A1MEN1KMT2ATP53POLB
SCHEMBL11320146 0.77 NPC1 (0.39) ALDH1A1MEN1KMT2ATP53POLB
SCHEMBL10833423 0.76 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ATP53POLB
SCHEMBL11586869 0.73 KMT2A (0.45) ALDH1A1MEN1KMT2ATP53POLB
SCHEMBL11030860 0.72 HSD11B1 (0.48) ALDH1A1MEN1KMT2ATP53POLB
SCHEMBL24305911 0.71 ALDH1A1 (0.68) ALDH1A1MEN1KMT2ATP53POLB
SCHEMBL9769991 0.71 SOAT1 (0.45) ALDH1A1MEN1KMT2ATP53POLB
Palmitamide SCHEMBL9769994 0.71 SOAT1 (0.45) ALDH1A1MEN1KMT2ATP53POLB
SCHEMBL18723118 0.71 ALDH1A1 (0.59) ALDH1A1KMT2ATP53POLBMAPT
SCHEMBL2373723 0.71 ALDH1A1 (0.60) ALDH1A1MEN1KMT2ATP53POLB

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-4171975-A MAGENTA COUPLER AND AN AMIDE KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1979-10-23 — — US disclosed
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