SCHEMBL16623003

SCHEMBL16623003

N[C@H]1CC(=O)N(c2ccc(Br)cc2)C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.52
MAPT P10636 6/20 0.47
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA4 P22748 2/20 0.46
CA6 P23280 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA5B Q9Y2D0 2/20 0.46
CA13 Q8N1Q1 1/20 0.46
POLB P06746 2/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPK1 P28482 2/20 0.44
HTT P42858 2/20 0.44
ALDH1A1 P00352 1/20 0.41
RECQL P46063 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
SCHEMBL19263522 1.00 RXFP1 (0.52) RXFP1MAPTCA12CA1CA2
SCHEMBL16623045 1.00 RXFP1 (0.52) RXFP1MAPTCA12CA1CA2
SCHEMBL11891161 0.82 TP53 (0.51) RXFP1MAPTPOLBMEN1KMT2A
SCHEMBL20901706 0.82 TSHR (0.55) MEN1KMT2ALMNASMN1; SMN2MAPK1
SCHEMBL20901666 0.82 TSHR (0.55) MEN1KMT2ALMNASMN1; SMN2MAPK1
SCHEMBL1534257 0.82 TDP1 (0.49) MAPTPOLBMEN1KMT2ALMNA
SCHEMBL18010611 0.82 TSHR (0.55) MEN1KMT2ALMNASMN1; SMN2MAPK1
SCHEMBL24324308 0.81 DPP4 (0.55) MAPTCA12CA1CA2CA4
SCHEMBL11030162 0.81 DPP4 (0.55) MAPTCA12CA1CA2CA4
Hydrochloric Acid SCHEMBL17967158 0.81 TSHR (0.54) MEN1KMT2ALMNASMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2857404-B1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVES AS KINASE INHIBITORS DAIICHI SANKYO CO LTD (JP) 2017-08-23 EP disclosed
EP-2857404-A1 IMIDAZO[1,2-b]PYRIDAZINE DERIVATIVE AS KINASE INHIBITOR Daiichi Sankyo Co., Ltd. (JP) 2015-04-08 EP disclosed