SCHEMBL16184162

SCHEMBL16184162

Clc1nc(-c2cccnc2)nc2c(Br)cccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.46
▸ ALDH1A1 P00352 8/20 0.44
▸ HPGD P15428 5/20 0.44
▸ MAPT P10636 5/20 0.44
▸ LMNA P02545 4/20 0.44
▸ KDM4E B2RXH2 4/20 0.44
▸ NPC1 O15118 4/20 0.44
▸ SMN1; SMN2 Q16637 6/20 0.43
▸ HSD17B10 Q99714 3/20 0.43
▸ TP53 P04637 3/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ CHRNB2 P17787 1/20 0.43
▸ CHRNA5 P30532 1/20 0.43
▸ CHRNA4 P43681 1/20 0.43
▸ POLB P06746 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ CYP2A6 P11509 2/20 0.42
▸ CYP1A2 P05177 5/20 0.42
▸ CYP3A4 P08684 5/20 0.42

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
SCHEMBL14358728 0.82 SMN1; SMN2 (0.47) KMT2AALDH1A1HPGDMAPTLMNA
SCHEMBL16184099 0.81 NPC1 (0.54) KMT2AALDH1A1HPGDMAPTLMNA
SCHEMBL2155611 0.78 CHRNB2 (0.43) KMT2AALDH1A1HPGDMAPTLMNA
SCHEMBL29416346 0.77 ALDH1A1 (0.62) KMT2AALDH1A1HPGDMAPTLMNA
SCHEMBL7286466 0.77 ALDH1A1 (0.62) KMT2AALDH1A1HPGDMAPTLMNA
SCHEMBL2155189 0.77 SMN1; SMN2 (0.44) KMT2AALDH1A1HPGDMAPTLMNA
SCHEMBL28031935 0.77 ALDH1A1 (0.50) KMT2AALDH1A1HPGDMAPTLMNA
SCHEMBL16183310 0.74 KMT2A (0.52) KMT2AALDH1A1HPGDMAPTLMNA
SCHEMBL2162585 0.74 CYP11B1 (0.49) KMT2AALDH1A1HPGDMAPTLMNA
SCHEMBL16184159 0.74 NPC1 (0.44) KMT2AALDH1A1HPGDMAPTLMNA

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 KMT2A 800/4885ALDH1A1 1687/4885HPGD 4227/4885

“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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