SCHEMBL7067134

SCHEMBL7067134

CCC(=O)Nc1[c]cc[c]c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
ATM Q13315 2/20 0.36
MAPT P10636 2/20 0.36
POLB P06746 2/20 0.36
GAA P10253 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 5/20 0.35
PKM P14618 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
CCR6 P51684 1/20 0.35
MCL1 Q07820 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35

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
SCHEMBL7068047 0.86 TP53 (0.43) CA12CA1CA2CA9MAPT
SCHEMBL11410301 0.83 ALDH1A1 (0.43) CA12CA1CA2CA9ATM
SCHEMBL5158336 0.79 SMN1; SMN2 (0.34) CA12CA1CA2CA9MAPT
SCHEMBL11599488 0.76 SMN1; SMN2 (0.37) MAPTALDH1A1LMNASMN1; SMN2HPGD
SCHEMBL11410354 0.74 CA1 (0.38) CA12CA1CA2CA9MAPT
SCHEMBL1133942 0.74 MAPT (0.47) ATMMAPTPOLBGAAKMT2A
SCHEMBL28133226 0.70 MEN1 (0.49) ATMMAPTPOLBGAAKMT2A
SCHEMBL11601668 0.69
SCHEMBL359542 0.69 GAA (0.54) CA12CA1CA2CA9ATM
SCHEMBL2900696 0.69 ALDH1A1 (0.47) MAPTPOLBGAAKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0765965-B1 Process for deying synthetic fibrous polyamid materials DYSTAR TEXTILFARBEN GMBH & CO (DE) 2003-06-04 EP disclosed
EP-0765918-B1 Reactive dye preparations DYSTAR TEXTILFARBEN GMBH & CO (DE) 1999-07-28 EP disclosed
US-5810890-A USING SPECIFIED MIXTURE OF DYES; INCREASED BRIGHTNESS AND LEVELNESS DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-09-22 US disclosed
US-5803930-A MIXTURE OF TWO DIFFERENT WATER SOLUBLE DYES; DYEING SYNTHETIC POLYAMIDES DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-09-08 US disclosed
EP-0765918-A2 Reactive dye preparations DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1997-04-02 EP disclosed
EP-0765965-A2 Process for deying synthetic fibrous polyamid materials DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1997-04-02 EP disclosed
US-4202814-A AZO DYES GIVING FAST RED COLOR CIBA-GEIGY CORPORATION (US) 1980-05-13 US disclosed