SCHEMBL9815014

SCHEMBL9815014

CC1=Nc2ccc3cc(S(=O)(=O)O)ccc3c2C1(C)C.[NaH]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ALDH1A1 P00352 5/20 0.42
CASP6 P55212 4/20 0.42
CYP2C9 P11712 3/20 0.42
CYP2C19 P33261 2/20 0.42
HSD17B10 Q99714 2/20 0.42
CYP1A2 P05177 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
POLB P06746 1/20 0.41
SNCA P37840 2/20 0.40
NSD2 O96028 3/20 0.38
NT5E P21589 2/20 0.38
HIF1A Q16665 3/20 0.37
TSHR P16473 1/20 0.37
PTPRA P18433 1/20 0.37
PTPRB P23467 1/20 0.37

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
SCHEMBL4296859 0.99 MEN1 (0.56) MEN1KMT2AALDH1A1CASP6CYP2C9
SCHEMBL28948590 0.97 MEN1 (0.55) MEN1KMT2AALDH1A1CASP6CYP2C9
SCHEMBL101283 0.89 KMT2A (0.57) MEN1KMT2AALDH1A1CASP6CYP2C9
Potassium Ion SCHEMBL30084855 0.86 MEN1 (0.55) MEN1KMT2AALDH1A1CASP6CYP2C9
SCHEMBL9815017 0.86 MEN1 (0.55) MEN1KMT2AALDH1A1CASP6CYP2C9
SCHEMBL4021394 0.86 MEN1 (0.55) MEN1KMT2AALDH1A1CASP6CYP2C9
Potassium Ion SCHEMBL4296985 0.86 MEN1 (0.55) MEN1KMT2AALDH1A1CASP6CYP2C9
SCHEMBL1369157 0.82 MEN1 (0.43) MEN1KMT2AALDH1A1CASP6CYP2C9
SCHEMBL136734 0.81 MEN1 (0.44) MEN1KMT2AALDH1A1CASP6CYP2C9
SCHEMBL14695213 0.80 MEN1 (0.43) MEN1KMT2AALDH1A1CASP6CYP2C9

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-0288076-B1 INFRARED FILTER DYES FOR PHOTOGRAPHIC ELEMENTS EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1991-09-04 EP disclosed
US-4871656-A SULFO-SUBSTITUTED INDOLE, BENZINDOLE OR NAPHTHINDOLE TRICARBOCYANINE DYE EASTMAN KODAK COMPANY (US) 1989-10-03 US disclosed
EP-0288076-A2 Infrared filter dyes for photographic elements EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1988-10-26 EP disclosed