SCHEMBL6897786

SCHEMBL6897786

C=C1CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.79

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 0.79
CYP3A4 P08684 1/20 0.79
LMNA P02545 2/20 0.65
MAPT P10636 2/20 0.65
KDM4E B2RXH2 1/20 0.55
ALDH1A1 P00352 1/20 0.55
ABCB11 O95342 1/20 0.55
NR3C1 P04150 1/20 0.55
PGR P06401 1/20 0.55
HTR2A P28223 1/20 0.55
OPRK1 P41145 1/20 0.55
HTR2B P41595 1/20 0.55

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
Androstenedone SCHEMBL12430773 0.88 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPT
Androstenedone SCHEMBL27795830 0.88 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPT
Androstenedone SCHEMBL134061 0.88 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPT
Androstenedone SCHEMBL3758714 0.88 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPT
Androstenedone SCHEMBL14450072 0.88 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPT
Androstenedone SCHEMBL1144460 0.88 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPT
Androstenedone SCHEMBL172864 0.88 CYP19A1 (1.00) CYP19A1CYP3A4LMNAMAPT
Androstenedone SCHEMBL10597170 0.87 CYP19A1 (0.97) CYP19A1CYP3A4LMNAMAPT
SCHEMBL14447980 0.85 CYP19A1 (0.57) CYP19A1CYP3A4LMNAMAPT
SCHEMBL11127319 0.84 CYP19A1 (0.73) CYP19A1CYP3A4LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1340502-A2 Androstane steroids as neurochemical initiators of change in human hypothalamic function and related pharmaceutical compositions and methods PHERIN CORPORATION (US) 2003-09-03 EP claimed
EP-0891188-A4 STEROIDS AS NEUROCHEMICAL INITIATORS OF CHANGE IN HUMAN BLOOD LEVELS OF LH OR FSH PHERIN PHARM INC (US) 2004-09-01 EP disclosed
US-20020103391-A1 Novel androstanes for inducing hypothalamic effects BERLINER DAVID L (US) 2002-08-01 US disclosed
US-6331534-B1 ADMINISTERING EFFECTIVE AMOUNT OF STEROID WITHIN NASAL PASSAGE OF INDIVIDUAL SUCH THAT IT BINDS SPECIFICALLY TO RECEPTORS ON SURFACE OF NASAL NEUROEPITHELIAL CELLS IN VOMERONASAL ORGAN PHERIN PHARMACEUTICALS, INC. 2001-12-18 US disclosed
US-6117860-A NASALLY ADMINISTERING STEROID WHICH BINDS TO A SPECIFIC NEUROEPITHELIAL RECEPTOR FOR ALLEVIATING PREMENSTRUAL TENSION AND ANXIETY PHERIN PHARMACEUTICALS, INC. (US) 2000-09-12 US disclosed
US-6066627-A ALTERING BLOOD CONCNETRATION OF LUTEINIZING HORMONE PHERIN CORPORATION (US) 2000-05-23 US disclosed
US-6057439-A EPOXYSTEROIDS PHERIN CORPORATION (US) 2000-05-02 US disclosed
US-5969168-A STIMULATE AUTONOMIC ACTIVITY PHERIN CORPORATION (US) 1999-10-19 US disclosed
EP-0891188-A1 STEROIDS AS NEUROCHEMICAL INITIATORS OF CHANGE IN HUMAN BLOOD LEVELS OF LH OR FSH Pherin Pharmaceuticals, Inc. (US) 1999-01-20 EP disclosed
EP-0783512-A4 NOVEL ANDROSTANES FOR INDUCING HYPOTHALAMIC EFFECTS PHERIN CORP (US) 1998-09-02 EP disclosed
WO-1998014194-A1 STEROIDS AS NEUROCHEMICAL STIMULATORS OF THE VNO TO ALLEVIATE SYMPTOMS OF ANXIETY PHERIN PHARMACEUTICALS (US) 1998-04-09 WO disclosed
WO-1997036596-A9 STEROIDS AS NEUROCHEMICAL INITIATORS OF CHANGE IN HUMAN BLOOD LEVELS OF LH OR FSH 1997-12-04 WO disclosed
WO-1997036596-A1 STEROIDS AS NEUROCHEMICAL INITIATORS OF CHANGE IN HUMAN BLOOD LEVELS OF LH OR FSH PHERIN PHARMACEUTICALS, INC. (US) 1997-10-09 WO disclosed
EP-0783512-A1 NOVEL ANDROSTANES FOR INDUCING HYPOTHALAMIC EFFECTS PHERIN CORPORATION (US) 1997-07-16 EP disclosed
WO-1996010031-A1 NOVEL ANDROSTANES FOR INDUCING HYPOTHALAMIC EFFECTS PHERIN CORPORATION (US) 1996-04-04 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-20020103391-A1 Novel androstanes for inducing hypothalamic effects FABP7, NR3C2, NR3C1 CYP19A1 109/4885CYP3A4 470/4885LMNA 4707/4885

“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.