SCHEMBL9705392

SCHEMBL9705392

Clc1ccccc1O[CH]Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.41
RAB9A P51151 3/20 0.41
HPGD P15428 4/20 0.40
KMT2A Q03164 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MEN1 O00255 3/20 0.40
TP53 P04637 2/20 0.40
NPC1 O15118 2/20 0.40
MITF O75030 1/20 0.40
XBP1 P17861 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
PKM P14618 2/20 0.38
CXCL8 P10145 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL7494685 0.76 L3MBTL1 (0.41) RAB9AHPGDKMT2ASMN1; SMN2MEN1
SCHEMBL8981676 0.74 KDM4E (0.45) RAB9AHPGDKMT2ASMN1; SMN2MEN1
SCHEMBL1064715 0.73 PPARG (0.42) MAOBL3MBTL1DRD2DRD4DRD3
SCHEMBL535467 0.73 LMNA (0.42) RAB9AHPGDKMT2ASMN1; SMN2MEN1
SCHEMBL1070130 0.73 MAOB (0.50) MAOBKMT2ATP53ALDH1A1DRD2
SCHEMBL3047774 0.69 HPGD (0.69) RAB9AHPGDKMT2ASMN1; SMN2MEN1
SCHEMBL194684 0.69 ALDH1A1 (0.44) HPGDKMT2ASMN1; SMN2MEN1RXRA
SCHEMBL29960351 0.69 ALDH1A1 (0.44) HPGDKMT2ASMN1; SMN2MEN1RXRA
SCHEMBL54889 0.69 LMNA (0.47) HPGDKMT2ASMN1; SMN2MEN1TP53
SCHEMBL29152933 0.69 SMN1; SMN2 (0.42) RAB9AHPGDKMT2ASMN1; SMN2MEN1

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-5159117-A Reacting ketone or aldehyde with nitrites in presence of acid catalyst BASF AKTIENGESELLSCHAFT (DE) 1992-10-27 US disclosed