SCHEMBL5423822

SCHEMBL5423822

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

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 2/20 0.51
CYP19A1 P11511 13/20 0.43
SRD5A2 P31213 1/20 0.40
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
SHBG P04278 1/20 0.39
SERPINA6 P08185 1/20 0.39
GUSB P08236 1/20 0.39
CYP3A4 P08684 1/20 0.39
G6PD P11413 1/20 0.39
PMP22 Q01453 1/20 0.39
KMT2A Q03164 1/20 0.39
GPBAR1 Q8TDU6 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL5423817 1.00 SRD5A1 (0.51) SRD5A1CYP19A1SRD5A2MEN1LMNA
SCHEMBL7529519 0.83 CYP19A1 (0.58) SRD5A1CYP19A1MEN1LMNASHBG
SCHEMBL3797856 0.83 CYP19A1 (0.58) SRD5A1CYP19A1MEN1LMNASHBG
SCHEMBL7523365 0.79 CYP17A1 (0.57) SRD5A1CYP19A1SRD5A2MEN1LMNA
SCHEMBL3803940 0.79 CYP17A1 (0.57) SRD5A1CYP19A1SRD5A2MEN1LMNA
SCHEMBL3803939 0.79 CYP17A1 (0.57) SRD5A1CYP19A1SRD5A2MEN1LMNA
SCHEMBL7523360 0.79 CYP17A1 (0.57) SRD5A1CYP19A1SRD5A2MEN1LMNA
SCHEMBL7523372 0.79 CYP17A1 (0.57) SRD5A1CYP19A1SRD5A2MEN1LMNA
SCHEMBL10274355 0.79 CYP19A1 (0.66) CYP19A1MEN1LMNASHBGSERPINA6
SCHEMBL5183886 0.79 SRD5A1 (0.53) SRD5A1CYP19A1SRD5A2

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-7186728-B2 Methylene-4-azasteroids SCHERING AG (DE) 2007-03-06 US disclosed
US-20040248921-A1 Methylene-4-azasteroids SCHERING AG (DE) 2004-12-09 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 (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-20040248921-A1 Methylene-4-azasteroids CYP17A1, NR5A1, HSD3B1 SRD5A1 8/4885CYP19A1 7/4885SRD5A2 6/4885

“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.