SCHEMBL10548744

SCHEMBL10548744

CN(CCc1ccccc1)C(=O)c1ccc(C(=O)CBr)o1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MLYCD O95822 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ LTB4R Q15722 6/20 0.43
▸ LTB4R2 Q9NPC1 6/20 0.43
▸ NPY5R Q15761 1/20 0.41
▸ TAAR1 Q96RJ0 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ OPRD1 P41143 1/20 0.41
▸ OPRK1 P41145 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ABCC1 P33527 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
SCHEMBL10546055 0.84 MLYCD (0.51) MLYCDALDH1A1LMNALTB4RLTB4R2
SCHEMBL10544853 0.78 ALDH1A1 (0.45) ALDH1A1LMNAMEN1MAPTKMT2A
SCHEMBL10546095 0.77 KMT2A (0.44) ALDH1A1LMNAMEN1MAPTKMT2A
SCHEMBL8472943 0.76 LTB4R (0.55) MLYCDLTB4RLTB4R2NPY5RTAAR1
SCHEMBL10546758 0.75 RIPK1 (0.51) ALDH1A1LMNATAAR1MEN1MAPT
SCHEMBL12133560 0.74 MLYCD (0.72) MLYCDTAAR1MEN1KMT2A
SCHEMBL10546564 0.73 ALDH1A1 (0.51) ALDH1A1LMNAMEN1MAPTKMT2A
SCHEMBL10547048 0.73 TP53 (0.48) ALDH1A1LMNASMN1; SMN2
SCHEMBL10544009 0.72 ALDH1A1 (0.42) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL1520363 0.71 KMT2A (0.59) MLYCDLTB4RLTB4R2NPY5RTAAR1

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-4814341-A HISTAMINE H2 ANTAGONISTS REITER LAWRENCE A (US) 1989-03-21 — — US disclosed
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