SCHEMBL9602629

SCHEMBL9602629

COS(=O)(=O)O.Clc1ccc2nc3ccccc3nc2c1

nearest known ligand 0.46

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.46
KMT2A Q03164 8/20 0.46
NQO2 P16083 4/20 0.46
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 3/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 4/20 0.44
USP2 O75604 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
PABPC1 P11940 1/20 0.41
HCRTR1 O43613 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
PIK3R1 P27986 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
SCHEMBL9603204 0.86 KDM4E (0.54) MEN1KMT2ANQO2KDM4EALDH1A1
Phenazine SCHEMBL10876543 0.84 MAPT (0.50) MEN1KMT2ANQO2KDM4EALDH1A1
Phenazine SCHEMBL2873102 0.84 MAPT (0.50) MEN1KMT2ANQO2KDM4EALDH1A1
Phenazine SCHEMBL94396 0.84 MAPT (0.50) MEN1KMT2ANQO2KDM4EALDH1A1
SCHEMBL4063489 0.81 KMT2A (0.47) MEN1KMT2ANQO2KDM4EALDH1A1
SCHEMBL29856205 0.80 NQO2 (0.56) MEN1KMT2ANQO2KDM4EALDH1A1
SCHEMBL5157721 0.80 NQO2 (0.56) MEN1KMT2ANQO2KDM4EALDH1A1
SCHEMBL9603007 0.78 TDP1 (0.57) MEN1KMT2ANQO2KDM4EALDH1A1
Acridine SCHEMBL2823221 0.78 ALDH1A1 (0.58) MEN1KMT2ANQO2KDM4EALDH1A1
SCHEMBL5157381 0.74 PIK3CG (0.58) MEN1KMT2ANQO2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0250676-B1 NON-ENZYMATIC IMMUNOHISTOCHEMICAL STAINING SYSTEM AND REAGENTS Immunomedics, Inc. (US) 1993-03-10 EP disclosed
US-4792521-A Non-enzymatic immunohistochemical staining system and reagents IMMUNOMEDICS, INC. (US) 1988-12-20 US disclosed
EP-0250676-A2 Non-enzymatic immunohistochemical staining system and reagents Immunomedics, Inc. (US) 1988-01-07 EP disclosed