SCHEMBL14501908

SCHEMBL14501908

Cc1cc2ccccc2n2nnnc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.60
KMT2A Q03164 9/20 0.60
TNKS O95271 4/20 0.50
KDM4E B2RXH2 8/20 0.49
ALDH1A1 P00352 4/20 0.49
HSD17B10 Q99714 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HPGD P15428 2/20 0.49
RXFP1 Q9HBX9 2/20 0.46
MAPT P10636 7/20 0.46
RAB9A P51151 3/20 0.46
HTT P42858 3/20 0.46
NPC1 O15118 1/20 0.46
MAPK1 P28482 3/20 0.44
TOP1 P11387 1/20 0.43
TSHR P16473 2/20 0.42
RECQL P46063 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL15131095 0.79 KMT2A (0.56) MEN1KMT2ATNKSKDM4EALDH1A1
SCHEMBL21037223 0.79 KMT2A (0.56) MEN1KMT2ATNKSKDM4EALDH1A1
SCHEMBL4489136 0.77 KMT2A (0.57) MEN1KMT2ATNKSKDM4EALDH1A1
SCHEMBL14209236 0.76 KMT2A (0.56) MEN1KMT2ATNKSKDM4EALDH1A1
SCHEMBL11326239 0.75 KMT2A (0.53) MEN1KMT2ATNKSKDM4EALDH1A1
SCHEMBL4497665 0.74 MEN1 (0.55) MEN1KMT2ATNKSKDM4EALDH1A1
SCHEMBL14209188 0.73 MEN1 (0.47) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL4497379 0.73 MEN1 (0.54) MEN1KMT2ATNKSKDM4EALDH1A1
SCHEMBL4492144 0.73 KMT2A (0.54) MEN1KMT2ATNKSKDM4EALDH1A1
SCHEMBL4487724 0.73 KMT2A (0.54) MEN1KMT2ATNKSKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4289813-A2 INTERMEDIATES TO OBTAIN SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION Global Blood Therapeutics, Inc. (US) 2023-12-13 EP disclosed
EP-3738434-A1 INTERMEDIATES TO OBTAIN SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION Global Blood Therapeutics, Inc. (US) 2020-11-18 EP disclosed
EP-3141542-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION Global Blood Therapeutics, Inc. (US) 2017-03-15 EP disclosed
US-20160206614-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION GLOBAL BLOOD THERAPEUTICS, INC. 2016-07-21 US disclosed
US-20150344472-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION GLOBAL BLOOD THERAPEUTICS, INC. 2015-12-03 US disclosed
US-9018210-B2 Substituted benzaldehyde compounds and methods for their use in increasing tissue oxygenation GLOBAL BLOOD THERAPEUTICS, INC. (US) 2015-04-28 US disclosed
US-20130190315-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION GLOBAL BLOOD THERAPEUTICS, INC. (US) 2013-07-25 US disclosed
WO-2013102142-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION GLOBAL BLOOD THERAPEUTICS, INC. (US) 2013-07-04 WO disclosed
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them RIGEL PHARMACEUTICALS, INC. (US) 2007-06-28 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 (4 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-20150344472-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION HBB, HBG2, MB MEN1 4829/4885KMT2A 1436/4885TNKS 2509/4885
US-20070149520-A1 HCV Inhibitors And Methods Of Using Them HAVCR2, GLS2, EIF2AK2 MEN1 4880/4885KMT2A 4081/4885TNKS 3417/4885
US-20160206614-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION HBB, HBG2, MB MEN1 4829/4885KMT2A 1436/4885TNKS 2509/4885
US-20130190315-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION HBB, HBG2, MB MEN1 4829/4885KMT2A 1436/4885TNKS 2509/4885

“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.