SCHEMBL8478993

SCHEMBL8478993

O=C(n1cc(-c2ccccc2)c2ccccc21)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.50
HTR6 P50406 3/20 0.44
PTGER1 P34995 1/20 0.43
KDM4E B2RXH2 2/20 0.40
CPT2 P23786 1/20 0.40
CPT1A P50416 1/20 0.40
CPT1B Q92523 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HSD17B10 Q99714 1/20 0.40
BRD4 O60885 1/20 0.39
F2RL3 Q96RI0 1/20 0.39
BRPF1 P55201 1/20 0.39
CREBBP Q92793 1/20 0.39
BRD9 Q9H8M2 1/20 0.39
DYRK1A Q13627 1/20 0.38
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 2/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL7582044 0.82 HTT (0.56) HTTHTR6PTGER1KDM4ECPT2
SCHEMBL8481500 0.79 HTT (0.75) HTTHTR6PTGER1KDM4EHSD17B10
SCHEMBL8483648 0.78 CFD (0.40) HTTHTR6
SCHEMBL8483654 0.78 CFD (0.40) HTTHTR6
SCHEMBL8482994 0.78 DYRK1A (0.58) HTTHTR6KDM4ECPT2CPT1A
SCHEMBL2002570 0.75 TRPV1 (0.48) HTR6CPT2CPT1ACPT1BKMT2A
SCHEMBL5415657 0.73 F2RL3 (0.54) HTTHTR6KDM4ECPT2CPT1A
SCHEMBL8479325 0.72 MAPT (0.60) HTTPTGER1L3MBTL1DYRK1AKMT2A
SCHEMBL18002368 0.71 MAPT (0.60) KDM4EALDH1A1KMT2AMEN1IDO1
SCHEMBL18002373 0.71 MAPT (0.60) KDM4EALDH1A1KMT2AMEN1IDO1

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
US-5936098-A Process for producing indoline compounds and intermediates for the production of the same TOKYO TANABE COMPANY LIMITED (JP) 1999-08-10 US disclosed
EP-0810214-A1 PROCESS FOR PRODUCING INDOLINE COMPOUNDS AND INTERMEDIATES FOR THE PRODUCTION OF THE SAME TOKYO TANABE COMPANY LIMITED (JP) 1997-12-03 EP disclosed