SCHEMBL7956458

SCHEMBL7956458

O=S(=O)(NCc1ccccc1N1CCN(c2ccncc2)CC1)c1ccc(Br)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.43
CYP19A1 P11511 1/20 0.42
LSS P48449 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NAMPT P43490 2/20 0.39
RAB9A P51151 1/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL7958300 0.89 KMT2A (0.53) SMN1; SMN2LMNAMEN1KMT2ARAB9A
SCHEMBL7956464 0.87 SMN1; SMN2 (0.47) POLBSMN1; SMN2LMNACYP19A1MEN1
SCHEMBL7958986 0.86 HTR7 (0.51) SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL7956239 0.86 CYP19A1 (0.46) SMN1; SMN2LMNACYP19A1MEN1KMT2A
SCHEMBL7956461 0.82 ALDH1A1 (0.54) POLBSMN1; SMN2LMNACYP19A1MEN1
SCHEMBL7956809 0.81 SETDB1 (0.53) SMN1; SMN2MEN1KMT2ATSHRALDH1A1
SCHEMBL7967171 0.78 KMT2A (0.54) KMT2A
SCHEMBL7947618 0.76 KMT2A (0.49) MEN1KMT2ANAMPTMAPT
SCHEMBL7958994 0.76 GFER (0.50) POLBSMN1; SMN2LMNAKMT2AALDH1A1
SCHEMBL7956246 0.76 SMN1; SMN2 (0.44) SMN1; SMN2LMNACYP19A1MEN1KMT2A

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-6313127-B1 FOR THERAPY OF HYPERCHOLESTEROLEMIA OR ATHEROSCLEROSIS ZENECA LIMITED (GB) 2001-11-06 US disclosed