SCHEMBL17837491

SCHEMBL17837491

CC(C)(C)OC(=O)N1CC=C(c2nn(COCC[Si](C)(C)C)c3nccc(Cl)c23)CC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 7/20 0.41
GRM5 P41594 7/20 0.41
DGAT2 Q96PD7 1/20 0.40
EED O75530 2/20 0.40
RBBP4 Q09028 2/20 0.40
SUZ12 Q15022 2/20 0.40
EZH2 Q15910 2/20 0.40
PDE10A Q9Y233 1/20 0.39
GPR119 Q8TDV5 2/20 0.39
TNK2 Q07912 2/20 0.39
WNT3A P56704 1/20 0.39
PDK4 Q16654 1/20 0.38
CNR1 P21554 1/20 0.38
NAMPT P43490 1/20 0.38

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
SCHEMBL17837729 0.91 GRM1 (0.44) GRM1GRM5EEDRBBP4SUZ12
SCHEMBL17837904 0.89 GRM1 (0.42) GRM1GRM5EEDRBBP4SUZ12
SCHEMBL17844432 0.89 TRPV1 (0.33) CNR1
SCHEMBL17837694 0.86 GRM5 (0.47) GRM1GRM5DGAT2EEDRBBP4
SCHEMBL20365260 0.81 GRM1 (0.42) GRM1GRM5DGAT2PDE10AGPR119
SCHEMBL17534997 0.80 DGAT2 (0.37) GRM1GRM5DGAT2EEDRBBP4
SCHEMBL29900848 0.80 GRM5 (0.41) GRM1GRM5EEDRBBP4SUZ12
SCHEMBL27193438 0.80 EED (0.38) GRM1GRM5DGAT2EEDRBBP4
SCHEMBL17844418 0.79 LIMK1 (0.34) GRM1GRM5
SCHEMBL17844397 0.78 QDPR (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233829-B1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS PFIZER (US) 2019-08-14 EP disclosed
EP-3233829-B1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS PFIZER (US) 2019-08-14 EP disclosed
US-9593097-B2 Axl inhibitors PFIZER INC. (US) 2017-03-14 US disclosed
US-9593097-B2 Axl inhibitors PFIZER INC. (US) 2017-03-14 US disclosed
US-9593097-B2 Axl inhibitors PFIZER INC. (US) 2017-03-14 US disclosed
WO-2016097918-A1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS PFIZER INC. (US) 2016-06-23 WO disclosed
US-20160176850-A1 AXL INHIBITORS PFIZER INC. 2016-06-23 US disclosed
US-20160176850-A1 AXL INHIBITORS PFIZER INC. 2016-06-23 US disclosed
US-20160176850-A1 AXL INHIBITORS PFIZER INC. 2016-06-23 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 (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-20160176850-A1 AXL INHIBITORS AXL, FLT3, MERTK GRM1 1082/4885GRM5 1645/4885DGAT2 4446/4885

“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.