SCHEMBL3663786

SCHEMBL3663786

C=C(C)CC/C=C(\C)CC

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
ALOX15 P16050 3/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.38
CYP3A4 P08684 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
UGT1A1 P22309 1/20 0.38
SQLE Q14534 7/20 0.37
KDM4E B2RXH2 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
SCHEMBL3663788 1.00 KMT2A (0.42) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL1486008 0.86 KMT2A (0.34) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL11443586 0.83 KMT2A (0.41) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL9244268 0.83 KMT2A (0.46) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL11443587 0.83 KMT2A (0.41) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL2627756 0.80 BTN3A1 (0.45) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL7174933 0.79 TSHR (0.65) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL28246381 0.79 KMT2A (0.38) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL21936846 0.79 TSHR (0.65) KMT2AALOX15MAPTMEN1CYP3A4
SCHEMBL3699306 0.79 KMT2A (0.46) KMT2AALOX15MAPTMEN1CYP3A4

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-10208024-B2 2-aryl- and 2-heteroaryl-substituted 2-pyridazin-3(2H)-one compounds as inhibitors of FGFR tyrosine kinases ARRAY BIOPHARMA INC. (US) 2019-02-19 US disclosed
US-20170260168-A1 2-ARYL- AND 2-HETEROARYL-SUBSTITUTED 2-PYRIDAZIN-3(2H)-ONE COMPOUNDS AS INHIBITORS OF FGFR TYROSINE KINASES ARRAY BIOPHARMA, INC. 2017-09-14 US disclosed
EP-2203512-A1 THERMOPLASTIC OLEFIN COMPOSITION WITH IMPROVED HEAT DISTORTION TEMPERATURE Dow Global Technologies Inc. (US) 2010-07-07 EP disclosed
WO-2009042602-A1 THERMOPLASTIC OLEFIN COMPOSITION WITH IMPROVED HEAT DISTORTION TEMPERATURE DOW GLOBAL TECHNOLOGIES INC (US) 2009-04-02 WO 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-10208024-B2 2-aryl- and 2-heteroaryl-substituted 2-pyridazin-3(2H)-one compounds as inhibitors of FGFR tyrosine kinases FGFR1, FGFR2, FGFR3 KMT2A 594/4885ALOX15 4449/4885MAPT 3292/4885
US-20170260168-A1 2-ARYL- AND 2-HETEROARYL-SUBSTITUTED 2-PYRIDAZIN-3(2H)-ONE COMPOUNDS AS INHIBITORS OF FGFR TYROSINE KINASES FGFR1, FGFR2, FGFR3 KMT2A 594/4885ALOX15 4449/4885MAPT 3292/4885

“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.