SCHEMBL13771908

SCHEMBL13771908

CCCC(Oc1ccc(C#N)c(C(F)(F)F)c1)C(=O)NCc1ccc2c(c1)OCO2

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.56
USP2 O75604 1/20 0.47
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
HEXD Q8WVB3 1/20 0.43
HSD17B10 Q99714 2/20 0.43
MME P08473 1/20 0.42

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
SCHEMBL13771902 0.90 HPGD (0.48) HPGDUSP2TSHRSMN1; SMN2KMT2A
SCHEMBL13771909 0.88 MAPT (0.43) HPGDPOLB
SCHEMBL4133470 0.85 AR (0.47)
SCHEMBL4132662 0.84 AR (0.47)
SCHEMBL4133498 0.84 AR (0.47)
SCHEMBL4152252 0.82 AR (0.50)
SCHEMBL4147368 0.82 AR (0.50)
SCHEMBL4141069 0.82 AR (0.47) SMN1; SMN2KMT2AALDH1A1MEN1LMNA
SCHEMBL4146145 0.81 AR (0.48)
SCHEMBL13771910 0.81 AR (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090192202-A1 ANDROGEN MODULATORS PFIZER INC 2009-07-30 US disclosed
US-20090192202-A1 ANDROGEN MODULATORS PFIZER INC 2009-07-30 US disclosed
US-7507860-B2 Androgen modulators PFIZER INC. (US) 2009-03-24 US disclosed
US-7507860-B2 Androgen modulators PFIZER INC. (US) 2009-03-24 US disclosed
US-20070197641-A1 Androgen modulators HU LAIN-YEN 2007-08-23 US disclosed
US-20070197641-A1 Androgen modulators HU LAIN-YEN 2007-08-23 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-20070197641-A1 Androgen modulators AR, NR5A1, SHBG HPGD 768/4885USP2 2651/4885TSHR 364/4885
US-20090192202-A1 ANDROGEN MODULATORS AR, NR5A1, SHBG HPGD 768/4885USP2 2651/4885TSHR 364/4885

“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.