SCHEMBL20323710

SCHEMBL20323710

CCCNCCOCCCOC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.34
KDM4E B2RXH2 1/20 0.30
RECQL P46063 1/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL15510820 0.84 TSHR (0.40) TSHRALDH1A1
SCHEMBL18859435 0.83 HTR1B (0.34) TSHRALDH1A1
SCHEMBL8979951 0.79 TSHR (0.48) TSHRKDM4ERECQLALDH1A1
SCHEMBL20314556 0.78 CYP4F2 (0.35) TSHRCYP4F2CYP4A11
SCHEMBL20314555 0.78 CYP4F2 (0.35) TSHRCYP4F2CYP4A11
SCHEMBL20314559 0.78 CYP4F2 (0.35) TSHRCYP4F2CYP4A11
SCHEMBL13668379 0.78 TSHR (0.40) TSHRKDM4ERECQLALDH1A1
SCHEMBL23945494 0.77 TSHR (0.50) TSHRKDM4ERECQLALDH1A1
SCHEMBL22473702 0.77 TSHR (0.50) TSHRKDM4ERECQLALDH1A1
SCHEMBL22837699 0.77 TSHR (0.48) TSHRALDH1A1

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
WO-2018119448-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES Arvinas, Inc. (US) 2018-06-28 WO disclosed