SCHEMBL17890180

SCHEMBL17890180

COc1ccc(C=Cc2nc(NCCCN3CCOCC3)c3ccccc3n2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 10/20 1.00
▸ MAPK1 P28482 2/20 0.59
▸ TP53 P04637 1/20 0.59
▸ ALOX15 P16050 1/20 0.59
▸ TSHR P16473 1/20 0.59
▸ CYP1A2 P05177 2/20 0.58
▸ CYP3A4 P08684 2/20 0.58
▸ CYP2D6 P10635 2/20 0.58
▸ CLK4 Q9HAZ1 2/20 0.58
▸ USP2 O75604 1/20 0.58
▸ CYP2C19 P33261 1/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ MELK Q14680 1/20 0.58
▸ ACP1 P24666 1/20 0.56
▸ MAPT P10636 2/20 0.55
▸ NPSR1 Q6W5P4 2/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ KDM4E B2RXH2 2/20 0.54
▸ POLB P06746 2/20 0.54
▸ KMT2A Q03164 2/20 0.54

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
SCHEMBL17890177 1.00 FLT3 (1.00) FLT3MAPK1TP53ALOX15TSHR
SCHEMBL17890242 0.91 FLT3 (0.83) FLT3MELK
SCHEMBL17890239 0.91 FLT3 (0.83) FLT3MELK
SCHEMBL17890268 0.91 FLT3 (1.00) FLT3PTGS2
SCHEMBL17890271 0.91 FLT3 (1.00) FLT3PTGS2
SCHEMBL3542133 0.88 FLT3 (0.79) FLT3MAPK1TP53ALOX15TSHR
SCHEMBL3542134 0.88 FLT3 (0.79) FLT3MAPK1TP53ALOX15TSHR
SCHEMBL17890320 0.88 FLT3 (1.00) FLT3MELK
SCHEMBL17890322 0.88 FLT3 (1.00) FLT3MELK
SCHEMBL17890098 0.88 FLT3 (1.00) FLT3MAPK1TP53ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9951029-B2 Styryl quinazoline derivatives as pharmaceutically active agents VICHEM CHEMIE KUTATÓ KFT. (HU) 2018-04-24 — — US disclosed
US-20160194291-A1 STYRYL QUINAZOLINE DERIVATIVES AS PHARMACEUTICALLY ACTIVE AGENTS VICHEM CHEMIE KUTATÓ KFT. (HU) 2016-07-07 — — 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-20160194291-A1 STYRYL QUINAZOLINE DERIVATIVES AS PHARMACEUTICALLY ACTIVE AGENTS FLT3, BCR, STK3 FLT3 1/4885MAPK1 1098/4885TP53 18/4885

“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.

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