SCHEMBL17837840

SCHEMBL17837840

O=C(NCC(F)(F)F)c1cc(Cl)nc(Cl)n1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.46
ATF1 P18846 1/20 0.39
NFKB1 P19838 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
SCN9A Q15858 2/20 0.37
SCN10A Q9Y5Y9 2/20 0.37
NAPEPLD Q6IQ20 1/20 0.37
LMNA P02545 1/20 0.37
ULK1 O75385 4/20 0.37
CFTR P13569 3/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL17837730 0.81 LOXL2 (0.41) LOXL2SMN1; SMN2SCN9ASCN10ANAPEPLD
SCHEMBL3028308 0.79 BCHE (0.46) LOXL2SMN1; SMN2LMNAULK1MEN1
SCHEMBL17837381 0.79 BRD4 (0.45) NAPEPLDLMNAMEN1KMT2A
SCHEMBL549344 0.78 LOXL2 (0.52) LOXL2SMN1; SMN2SCN9ASCN10AULK1
SCHEMBL31373554 0.76 LMNA (0.48) ATF1NFKB1LMNAMEN1KMT2A
SCHEMBL29197138 0.72 POLB (0.42) ATF1NFKB1LMNA
SCHEMBL17066002 0.72 LOXL2 (0.46) LOXL2SMN1; SMN2SCN9ASCN10ALMNA
SCHEMBL26786803 0.71 P2RX7 (0.51) LOXL2SCN9ASCN10ALMNAULK1
SCHEMBL294393 0.71 LOXL2 (0.66) LOXL2SMN1; SMN2ULK1KMT2A
SCHEMBL5635889 0.71 ATF1 (0.39) ATF1NFKB1SMN1; SMN2SCN9A

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 11 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
EP-3233829-A1 PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS Pfizer Inc (US) 2017-10-25 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
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 LOXL2 1772/4885ATF1 2255/4885NFKB1 2771/4885

“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.