SCHEMBL4107682

SCHEMBL4107682

CNC(=O)Cn1nc(C2CC2)c(Oc2cc(C)c(C#N)c(C)c2)c1C1CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.46
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 5/20 0.33
GLA P06280 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 5/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.31
HCRTR1 O43613 3/20 0.31
HCRTR2 O43614 3/20 0.31
MAPK1 P28482 1/20 0.31
RCE1 Q9Y256 1/20 0.31
PFKFB2 O60825 1/20 0.30
PFKFB1 P16118 1/20 0.30
PFKFB3 Q16875 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
PKM P14618 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL4104626 0.91 PGR (0.42) PGRMEN1KMT2AALDH1A1GLA
SCHEMBL4104566 0.91 PGR (0.46) PGRMEN1KMT2AALDH1A1GLA
SCHEMBL4110642 0.89 PGR (0.41) PGRMEN1KMT2AALDH1A1GLA
SCHEMBL4111142 0.89 PGR (0.45) PGRMEN1KMT2AALDH1A1GLA
SCHEMBL4960690 0.89 PGR (0.35) PGRMEN1KMT2AALDH1A1KDM4E
SCHEMBL4751253 0.89 PGR (0.40) PGRMEN1KMT2AALDH1A1GLA
SCHEMBL4748737 0.89 PGR (0.44) PGRMEN1KMT2AALDH1A1GLA
SCHEMBL4110151 0.88 ALDH1A1 (0.35) PGRMEN1KMT2AALDH1A1GLA
SCHEMBL4112533 0.88 PGR (0.48) PGRHCRTR1HCRTR2PFKFB2PFKFB1
SCHEMBL4102713 0.84 PGR (0.64) PGRMEN1KMT2ARAB9AKDM4E

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
US-7482375-B2 Compounds useful in therapy PFIZER INC. (US) 2009-01-27 US claimed
US-20090099209-A1 Compounds Useful in Therapy PFIZER INC 2009-04-16 US disclosed
US-7482375-B2 Compounds useful in therapy PFIZER INC. (US) 2009-01-27 US disclosed
US-20060241125-A1 Compounds useful in therapy BRADLEY PAUL A 2006-10-26 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-20060241125-A1 Compounds useful in therapy CBR3, GPER1, CBR1 PGR 57/4885MEN1 2554/4885KMT2A 3171/4885
US-20090099209-A1 Compounds Useful in Therapy CBR3, CBR1, GPER1 PGR 87/4885MEN1 2898/4885KMT2A 3346/4885

“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.