SCHEMBL19806050

SCHEMBL19806050

CC(C)(C)c1ccc(CC(C)(C)c2ccc(C3CC3)cc2)cc1OC(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
CNR2 P34972 15/20 0.33
HTR2C P28335 2/20 0.31
SPHK1 Q9NYA1 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
SCHEMBL19805983 0.79 ESR1 (0.32) ESR1ESR2CNR2
SCHEMBL22147201 0.78 SMN1; SMN2 (0.37) HTR2C
SCHEMBL24065732 0.74 HSD11B1 (0.36)
SCHEMBL20802199 0.72 NR3C1 (0.42)
SCHEMBL19431079 0.70 NR3C1 (0.40) ESR1ESR2CNR2
SCHEMBL25530871 0.70 CA1 (0.40)
SCHEMBL24065731 0.67 TSHR (0.34) CNR2
SCHEMBL21670003 0.65 GAA (0.38)
SCHEMBL26879793 0.65 ESR1 (0.44) ESR1ESR2
SCHEMBL18271995 0.65 ALOX15 (0.37) CNR2

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-10202354-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-12 US disclosed
US-20180022707-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-01-25 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 (2 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-20180022707-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF KDM1B, KDM6B, KDM2B ESR1 1302/4885ESR2 308/4885CNR2 1382/4885
US-10202354-B2 Therapeutic compounds and uses thereof KDM1B, KDM6B, KDM2B ESR1 1302/4885ESR2 308/4885CNR2 1382/4885

“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.