SCHEMBL15023604

SCHEMBL15023604

O=C(O)c1ccc(=O)n(CC(O)C(F)(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.37
BRD2 P25440 1/20 0.37
BRD3 Q15059 1/20 0.37
BRDT Q58F21 1/20 0.37
POLB P06746 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.35
TSHR P16473 3/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 3/20 0.34
HTT P42858 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
SRD5A2 P31213 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.32

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
SCHEMBL15023603 1.00 BRD4 (0.37) BRD4BRD2BRD3BRDTPOLB
SCHEMBL14406947 1.00 BRD4 (0.37) BRD4BRD2BRD3BRDTPOLB
SCHEMBL3168535 0.81 BRD4 (0.40) BRD4BRD2BRD3BRDTPOLB
SCHEMBL15023731 0.80 BRD4 (0.42) BRD4BRD2BRD3BRDTPOLB
SCHEMBL4922930 0.80 BRD4 (0.42) BRD4BRD2BRD3BRDTPOLB
SCHEMBL14406946 0.80 BRD4 (0.42) BRD4BRD2BRD3BRDTPOLB
SCHEMBL15046620 0.78 KDM4E (0.50) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL15046561 0.78 KDM4E (0.50) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL15046635 0.78 KDM4E (0.50) POLBMEN1KMT2AALDH1A1KDM4E
SCHEMBL14406953 0.78 PTGDR2 (0.44) BRD4BRD2BRD3BRDTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096527-B2 TRPM8 antagonists and their use in treatments AMGEN INC. (US) 2015-08-04 US disclosed
US-20140171406-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2014-06-19 US disclosed
US-20140171639-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2014-06-19 US disclosed
US-8710043-B2 TRPM8 antagonists and their use in treatments AMGEN INC. (US) 2014-04-29 US disclosed
US-20130157996-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2013-06-20 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 (3 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-20140171639-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS TRPM8, TRPM7, TRPM5 BRD4 2959/4885BRD2 3819/4885BRD3 3558/4885
US-20140171406-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS TRPM8, TRPM7, TRPM5 BRD4 2959/4885BRD2 3819/4885BRD3 3558/4885
US-20130157996-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS TRPM8, TRPM7, TRPM5 BRD4 2959/4885BRD2 3819/4885BRD3 3558/4885

“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.