SCHEMBL9618014

SCHEMBL9618014

NC1CC1(COCc1ccccc1)COCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
TACR1 P25103 7/20 0.45
IDO1 P14902 1/20 0.42
AGXT P21549 1/20 0.41
KDM1A O60341 2/20 0.40
TAAR1 Q96RJ0 1/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
SLC6A4 P31645 4/20 0.39
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38

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
SCHEMBL763932 0.80 TSHR (0.48) TSHRTACR1IDO1AGXTKDM1A
SCHEMBL1863524 0.80 TSHR (0.48) TSHRTACR1IDO1AGXTKDM1A
SCHEMBL1863521 0.80 TSHR (0.48) TSHRTACR1IDO1AGXTKDM1A
SCHEMBL9257357 0.75 TACR1 (0.43) TSHRTACR1KDM4EPOLBSLC6A4
SCHEMBL9264627 0.75 TACR1 (0.43) TSHRTACR1KDM4EPOLBSLC6A4
SCHEMBL8447457 0.75 TACR1 (0.43) TSHRTACR1KDM4EPOLBSLC6A4
SCHEMBL9264621 0.75 TACR1 (0.43) TSHRTACR1KDM4EPOLBSLC6A4
SCHEMBL4153126 0.73 MAOA (0.55) TSHRTACR1IDO1AGXTKDM4E
SCHEMBL763893 0.73 TSHR (0.48) TSHRTACR1IDO1KDM4EPOLB
SCHEMBL1857390 0.73 TSHR (0.48) TSHRTACR1IDO1KDM4EPOLB

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
JP-4283545-A None JP disclosed
JP-H04283545-A NEW CYCLOPROPANE DERIVATIVE NIPPON KAYAKU CO LTD 1992-10-08 JP disclosed