SCHEMBL9681634

SCHEMBL9681634

CC(C)(C(=O)c1ccc(Cl)cc1)N1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
KMT2A Q03164 5/20 0.44
MEN1 O00255 2/20 0.44
HSD17B10 Q99714 1/20 0.44
POLB P06746 2/20 0.44
USP2 O75604 1/20 0.43
ALOX15 P16050 1/20 0.43
CHRNA7 P36544 1/20 0.43
CHRM3 P20309 1/20 0.43
HPGD P15428 2/20 0.42
LMNA P02545 1/20 0.41
AKR1C3 P42330 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL10944065 0.86 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2TSHRMAPK1KMT2A
SCHEMBL10943847 0.86 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2TSHRMAPK1KMT2A
SCHEMBL10385895 0.85 POLB (0.58) ALDH1A1SMN1; SMN2TSHRMAPK1KMT2A
SCHEMBL9681689 0.84 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2TSHRMAPK1KMT2A
SCHEMBL14946370 0.84 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2TSHRMAPK1KMT2A
SCHEMBL2703478 0.83 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2TSHRMAPK1KMT2A
SCHEMBL11896651 0.83 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2TSHRMAPK1KMT2A
SCHEMBL17265631 0.83 SMN1; SMN2 (0.54) ALDH1A1SMN1; SMN2TSHRMAPK1KMT2A
SCHEMBL25391137 0.82 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2TSHRMAPK1KMT2A
SCHEMBL9680403 0.82 HPGD (0.52) ALDH1A1SMN1; SMN2TSHRMAPK1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5145885-A Morpholine compound, binders CIBA-GEIGY CORPORATION (US) 1992-09-08 US disclosed
US-4992547-A Aminoaryl ketone photoinitiators CIBA-GEIGY CORPORATION (US) 1991-02-12 US disclosed
US-4960746-A A-HYDROXY-OR A-AMINO-ACETOPHENONES AND A TITANOCENE COMPOUND SUBSTITUTED BY FLUORINE CIBA-GEIGY CORPORATION (US) 1990-10-02 US disclosed