SCHEMBL23514656

SCHEMBL23514656

CCc1ccc(C2(F)CN(C(C)C)C2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 2/20 0.38
OPRM1 P35372 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 2/20 0.33
HRH3 Q9Y5N1 3/20 0.32
CYP2D6 P10635 2/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GAA P10253 1/20 0.31
CHRM2 P08172 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31

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
SCHEMBL19567877 0.80 RAB9A (0.36) OPRD1OPRM1OPRK1OPRL1POLB
SCHEMBL20782184 0.78 SMN1; SMN2 (0.58) OPRD1OPRM1OPRK1OPRL1SMN1; SMN2
SCHEMBL26016246 0.76 ALDH1A1 (0.37) OPRD1OPRM1OPRK1OPRL1SMN1; SMN2
SCHEMBL12045165 0.75 TP53 (0.39) OPRD1OPRM1OPRK1OPRL1SMN1; SMN2
SCHEMBL23384014 0.70 OPRL1 (0.68) OPRD1OPRM1OPRK1OPRL1CYP2D6
SCHEMBL25004295 0.68 RORC (0.41) OPRD1OPRM1OPRK1OPRL1HRH3
SCHEMBL20781870 0.66 LMNA (0.32) POLBNPC1RAB9ALMNA
SCHEMBL23993210 0.66 CYP2D6 (0.59) OPRD1OPRM1OPRK1OPRL1SMN1; SMN2
SCHEMBL25004297 0.65 MAOA (0.42) OPRD1OPRM1OPRK1OPRL1CYP2D6
SCHEMBL10263723 0.64 POLB (0.58) SMN1; SMN2POLBHRH3KDM4EATM

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
US-20210179564-A1 THERAPEUTIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-06-17 US 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-20210179564-A1 THERAPEUTIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF JAK2, JAK1, JAK3 OPRD1 3149/4885OPRM1 2365/4885OPRK1 1322/4885

“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.