SCHEMBL19805986

SCHEMBL19805986

CC(C)c1ccc(C(C)(C)c2cccc(Cl)c2)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.41
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
CNR2 P34972 4/20 0.37
CNR1 P21554 3/20 0.37
RORC P51449 2/20 0.35
PNMT P11086 1/20 0.34
CYP19A1 P11511 2/20 0.34
SLC6A2 P23975 2/20 0.34
CHRNA1 P02708 1/20 0.34
CHRNG P07510 1/20 0.34
ITGA5 P08648 1/20 0.34
CHRNB1 P11230 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
SLC6A4 P31645 1/20 0.34
CHRNA3 P32297 1/20 0.34

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
SCHEMBL18647493 0.84 PDE2A (0.43) PDE2AESR1ESR2LMNATP53
SCHEMBL24772476 0.84 PDE2A (0.58) PDE2AESR1ESR2HTTALDH1A1
SCHEMBL8137247 0.80 ESR1 (0.50) ESR1ESR2CNR2CNR1PNMT
SCHEMBL21316113 0.77 PDE2A (0.50) PDE2ALMNATP53HTTCYP2C19
SCHEMBL19806049 0.77 ESR1 (0.42) PDE2AESR1ESR2LMNACNR2
SCHEMBL24772588 0.77 PDE2A (0.34) PDE2AESR1ESR2LMNACNR2
SCHEMBL19440628 0.74 CYP19A1 (0.38) ESR1ESR2CNR2CNR1RORC
SCHEMBL22863819 0.74 PDE2A (0.42) PDE2ALMNATP53HTTCNR2
SCHEMBL23095484 0.73 PDE2A (0.36) PDE2ALMNARORCPNMTALDH1A1
SCHEMBL31045502 0.72 LMNA (0.68) LMNATP53HTTALDH1A1

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 PDE2A 955/4885ESR1 1302/4885ESR2 308/4885
US-10202354-B2 Therapeutic compounds and uses thereof KDM1B, KDM6B, KDM2B PDE2A 955/4885ESR1 1302/4885ESR2 308/4885

“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.