SCHEMBL16184557

SCHEMBL16184557

COc1cc(-c2cccc(F)c2F)cc2c(NCCCN(C)C)nc(-c3cccnc3)nc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 6/20 0.41
▸ LMNA P02545 3/20 0.41
▸ USP2 O75604 2/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ CLK4 Q9HAZ1 2/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ RAD52 P43351 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ TP53 P04637 1/20 0.40

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
SCHEMBL16184556 0.95 PIM1 (0.42) GBA1LMNAUSP2CYP1A2CYP3A4
SCHEMBL16184476 0.94 LMNA (0.44) GBA1LMNAUSP2CYP1A2CYP3A4
SCHEMBL16184560 0.91 GBA1 (0.45) GBA1LMNAUSP2CYP1A2CYP3A4
SCHEMBL16184568 0.91 GBA1 (0.48) GBA1LMNAUSP2CYP1A2CYP3A4
SCHEMBL16184562 0.90 LMNA (0.49) GBA1LMNAUSP2CYP1A2CYP3A4
SCHEMBL16184569 0.89 USP2 (0.43) GBA1LMNAUSP2CYP1A2CYP3A4
SCHEMBL16184558 0.89 USP2 (0.43) GBA1LMNAUSP2CYP1A2CYP3A4
SCHEMBL16184613 0.89 KMT2A (0.42) GBA1LMNAUSP2CYP1A2CYP3A4
SCHEMBL16184585 0.89 KMT2A (0.42) GBA1LMNAUSP2CYP1A2CYP3A4
SCHEMBL16184559 0.88 GBA1 (0.44) GBA1LMNAUSP2CYP1A2CYP3A4

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-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 — — US disclosed
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 — — 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-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP2CA, PPP4C, PPP3CB GBA1 1316/4885LMNA 4832/4885USP2 2663/4885

“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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