SCHEMBL17097989

SCHEMBL17097989

CCOC(=O)[C@H]1CC[C@H](n2ncc(C(=O)N(Cc3ccc(F)cc3)CC(O[Si](CC)(CC)CC)c3c(Cl)cncc3Cl)c2C(F)(F)F)CC1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
POLB P06746 2/20 0.34
ALDH1A1 P00352 4/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CCR2 P41597 1/20 0.31
KCNH2 Q12809 1/20 0.31
HSD11B1 P28845 1/20 0.31
MDM2 Q00987 1/20 0.31
LMNA P02545 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
SCHEMBL17097991 1.00 TP53 (0.34) TP53TDP1POLBALDH1A1RECQL
SCHEMBL17099238 0.93 HSD11B1 (0.32) ALDH1A1KMT2AKDM4EHPGDMEN1
SCHEMBL17099237 0.93 HSD11B1 (0.32) ALDH1A1KMT2AKDM4EHPGDMEN1
SCHEMBL17048900 0.92 ALDH1A1 (0.32) ALDH1A1CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL17097676 0.91 TP53 (0.35) TP53TDP1POLBALDH1A1RECQL
SCHEMBL17097674 0.91 TP53 (0.35) TP53TDP1POLBALDH1A1RECQL
SCHEMBL17098678 0.88 KDM4E (0.34) ALDH1A1KDM4ECCR2KCNH2HSD11B1
SCHEMBL17098676 0.88 KDM4E (0.34) ALDH1A1KDM4ECCR2KCNH2HSD11B1
SCHEMBL17098272 0.86 HSD11B1 (0.31) KMT2AMEN1CCR2KCNH2HSD11B1
SCHEMBL17098270 0.86 HSD11B1 (0.31) KMT2AMEN1CCR2KCNH2HSD11B1

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-9365522-B2 Pyrazole amide derivative AMGEN INC. (US) 2016-06-14 US disclosed
US-9365522-B2 Pyrazole amide derivative AMGEN INC. (US) 2016-06-14 US disclosed
US-20150266824-A1 Pyrazole Amide Derivative TEIJIN LIMITED (JP) 2015-09-24 US disclosed
US-20150266824-A1 Pyrazole Amide Derivative TEIJIN LIMITED (JP) 2015-09-24 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-20150266824-A1 Pyrazole Amide Derivative RORC, RORB, RORA TP53 1806/4885TDP1 4296/4885POLB 4102/4885

“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.