SCHEMBL20780486

SCHEMBL20780486

CC(C)N1C[C@H](c2ccccc2)OC1=O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.47
FADS1 O60427 3/20 0.47
DDB1 Q16531 1/20 0.46
CRBN Q96SW2 1/20 0.46
HTR6 P50406 1/20 0.42
HSD11B1 P28845 2/20 0.42
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
MAOB P27338 4/20 0.39
KDM4E B2RXH2 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
AR P10275 1/20 0.39
CYP19A1 P11511 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.37
BRD4 O60885 3/20 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
SCHEMBL20794011 1.00 HTR2B (0.47) HTR2BFADS1DDB1CRBNHTR6
SCHEMBL13837966 1.00 HTR2B (0.47) HTR2BFADS1DDB1CRBNHTR6
SCHEMBL2898141 0.86 KMT2A (0.47) HTR2BFADS1DDB1CRBNHTR6
SCHEMBL20780472 0.84 HTR2B (0.37) HTR2BFADS1DDB1CRBN
SCHEMBL20780471 0.82 CYP3A4 (0.47) HTR2BKDM4ETSHRKMT2A
SCHEMBL9239754 0.82 TDP1 (0.43) HTR2BFADS1DDB1CRBNHTR6
SCHEMBL20780477 0.82 HTR6 (0.49) HTR2BFADS1HTR6
SCHEMBL2896905 0.81 HSD11B1 (0.42) FADS1DDB1CRBNHTR6HSD11B1
SCHEMBL20780487 0.80 CETP (0.40) HTR2BFADS1HSD11B1KMT2A
SCHEMBL20780482 0.79 HTR1A (0.56) HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210290623-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS DALCOR PHARMA UK LTD., LEATHERHEAD, ZUG BRANCH (CH) 2021-09-23 US disclosed
WO-2020030814-A1 METHODS FOR DELAYING OCCURRENCE OF NEW-ONSET TYPE 2 DIABETES AND FOR SLOWING PROGRESSION OF AND TREATING TYPE 2 DIABETES DALCOR PHARMA UK LTD., LEATHERHEAD, ZUG BRANCH (CH) 2020-02-13 WO disclosed
WO-2019043018-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS DALCOR PHARMA UK LTD., STOCKPORT ZUG BRANCH (CH) 2019-03-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210290623-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS HMGCR, PCSK9, FABP3 HTR2B 3170/4885FADS1 318/4885DDB1 1441/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.