SCHEMBL10274355

SCHEMBL10274355

C[C@]12CCCC(=O)NC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 17/20 0.66
MEN1 O00255 1/20 0.53
LMNA P02545 1/20 0.53
SHBG P04278 1/20 0.53
SERPINA6 P08185 1/20 0.53
GUSB P08236 1/20 0.53
CYP3A4 P08684 1/20 0.53
G6PD P11413 1/20 0.53
PMP22 Q01453 1/20 0.53
KMT2A Q03164 1/20 0.53
GPBAR1 Q8TDU6 1/20 0.53
TSHR P16473 1/20 0.53

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
SCHEMBL7529519 0.92 CYP19A1 (0.58) CYP19A1MEN1LMNASHBGSERPINA6
SCHEMBL3797856 0.92 CYP19A1 (0.58) CYP19A1MEN1LMNASHBGSERPINA6
SCHEMBL10273329 0.84 CYP19A1 (0.46) CYP19A1
SCHEMBL10273335 0.82 CYP19A1 (0.69) CYP19A1SHBGSERPINA6
SCHEMBL5183889 0.79 SRD5A1 (0.53) CYP19A1
SCHEMBL5183886 0.79 SRD5A1 (0.53) CYP19A1
SCHEMBL5423817 0.79 SRD5A1 (0.51) CYP19A1MEN1LMNASHBGSERPINA6
SCHEMBL5423822 0.79 SRD5A1 (0.51) CYP19A1MEN1LMNASHBGSERPINA6
SCHEMBL7523365 0.77 CYP17A1 (0.57) CYP19A1MEN1LMNASHBGSERPINA6
SCHEMBL3803939 0.77 CYP17A1 (0.57) CYP19A1MEN1LMNASHBGSERPINA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2660241-A2 C-17-HETEROARYL STEROIDAL COMPOUNDS AS INHIBITORS OF CYP11B, CYP17, AND/OR CYP21 BioMarin Pharmaceutical Inc. (US) 2013-11-06 EP disclosed
US-20130252930-A1 CYP11B, CYP17, AND/OR CYP21 INHIBITORS BIOMARIN PHARMACEUTICAL INC. (CA) 2013-09-26 US disclosed
US-20130252930-A1 CYP11B, CYP17, AND/OR CYP21 INHIBITORS BIOMARIN PHARMACEUTICAL INC. (CA) 2013-09-26 US disclosed
WO-2012083112-A2 CYP11B, CYP17, AND/OR CYP21 INHIBITORS BIOMARIN PHARMACEUTICAL INC. (US) 2012-06-21 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-20130252930-A1 CYP11B, CYP17, AND/OR CYP21 INHIBITORS CYP4A11, HSD17B11, CYP21A2 CYP19A1 10/4885MEN1 2870/4885LMNA 1844/4885

“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.