SCHEMBL17809579

SCHEMBL17809579

CN1CCCc2cc(-c3cccnc3)ccc21

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 18/20 0.62
CYP11B2 P19099 17/20 0.62
CYP1A2 P05177 2/20 0.62
CYP17A1 P05093 1/20 0.62
CYP19A1 P11511 1/20 0.62

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
SCHEMBL21646417 0.92 CYP11B2 (0.66) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL17809611 0.84 MEN1 (0.50) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL17806279 0.83 CYP11B1 (0.59) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL17809574 0.82 ALDH1A1 (0.51) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL17809777 0.82 CYP11B2 (0.48) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL21859175 0.78 NPC1 (0.46) CYP11B1CYP11B2CYP1A2
SCHEMBL17809769 0.78 WDR5 (0.48) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL17809560 0.77 CYP11B2 (0.62) CYP11B1CYP11B2CYP1A2
SCHEMBL24783563 0.77 CYP11B2 (0.66) CYP11B1CYP11B2CYP1A2CYP17A1CYP19A1
SCHEMBL17795410 0.77 CREBBP (0.54) CYP11B2

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-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-23 US disclosed
US-9763922-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2017-09-19 US disclosed
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-06-09 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-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 CYP11B1 1468/4885CYP11B2 1605/4885CYP1A2 3506/4885
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 CYP11B1 1468/4885CYP11B2 1605/4885CYP1A2 3506/4885

“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.