SCHEMBL3624397

SCHEMBL3624397

O=C(O)c1c(Br)ccc2cc3ccccc3cc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
KDM4E B2RXH2 3/20 0.58
HPGD P15428 2/20 0.58
HSD17B10 Q99714 2/20 0.58
CYP1A2 P05177 1/20 0.58
GLA P06280 1/20 0.58
CYP2C19 P33261 1/20 0.58
GAA P10253 1/20 0.43
RXFP1 Q9HBX9 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SOS1 Q07889 1/20 0.39
CDC25B P30305 2/20 0.38
WDR5 P61964 1/20 0.38
IDO1 P14902 1/20 0.38
HIF1A Q16665 1/20 0.38
CYP1B1 Q16678 1/20 0.38

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
SCHEMBL29414557 0.84 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL30024085 0.83 HSD17B10 (0.59) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL3807746 0.83 HSD17B10 (0.59) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL5068305 0.81 MEN1 (0.52) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL929603 0.80 ALDH1A1 (0.60) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL29506855 0.80 KDM4E (0.60) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL43510 0.80 KDM4E (0.60) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL4896934 0.79 ALDH1A1 (0.84) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL3371436 0.79 ALDH1A1 (0.55) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL31125071 0.79 KDM4E (0.69) ALDH1A1MEN1KMT2AKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230176481-A1 FILM-FORMING COMPOSITION NISSAN CHEMICAL CORPORATION (JP) 2023-06-08 US disclosed
US-10188910-B2 Golf ball SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2019-01-29 US disclosed
US-20180126226-A1 GOLF BALL DUNLOP SPORTS CO. LTD. (JP) 2018-05-10 US disclosed
US-9873022-B2 Golf ball DUNLOP SPORTS CO. LTD. (JP) 2018-01-23 US disclosed
EP-2610291-B1 GOLF BALL DUNLOP SPORTS CO LTD (JP) 2017-12-20 EP disclosed
US-9302158-B2 Golf ball DUNLOP SPORTS CO., LTD. (JP) 2016-04-05 US disclosed
US-20160008666-A1 GOLF BALL DUNLOP SPORTS CO., LTD. (JP) 2016-01-14 US disclosed
US-9174092-B2 Golf ball DUNLOP SPORTS CO. LTD. (JP) 2015-11-03 US disclosed
US-20140357406-A1 GOLF BALL DUNLOP SPORTS CO., LTD. (JP) 2014-12-04 US disclosed
US-8669375-B2 Process for producing ester compound WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2014-03-11 US disclosed
US-20130172111-A1 GOLF BALL DUNLOP SPORTS CO., LTD. (JP) 2013-07-04 US disclosed
EP-2610291-A2 Golf ball Dunlop Sports Co., Ltd. (JP) 2013-07-03 EP disclosed
US-20130066070-A1 PROCESS FOR PRODUCING ESTER COMPOUND WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2013-03-14 US disclosed
US-8318964-B2 Process for producing ester compound WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2012-11-27 US disclosed
US-20100324314-A1 PROCESS FOR PRODUCING ESTER COMPOUND WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-23 US disclosed
EP-1690685-B1 Planographic printing plate precursor FUJIFILM CORP (JP) 2009-04-15 EP disclosed
EP-1690685-A2 Planographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2006-08-16 EP 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-20130066070-A1 PROCESS FOR PRODUCING ESTER COMPOUND ADH1C, ADH5, ADH1A ALDH1A1 261/4885MEN1 1733/4885KMT2A 2021/4885
US-20100324314-A1 PROCESS FOR PRODUCING ESTER COMPOUND ADH1C, ADH5, ADH1A ALDH1A1 252/4885MEN1 1777/4885KMT2A 2032/4885

“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.