SCHEMBL9638522

SCHEMBL9638522

Cc1ccccc1NC(CS)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
HPGD P15428 4/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
POLB P06746 1/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45
HTT P42858 1/20 0.45
ITGB3 P05106 2/20 0.44
ITGAV P06756 2/20 0.44
ITGB1 P05556 1/20 0.44
ITGA5 P08648 1/20 0.44
KDM4E B2RXH2 2/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALOX12 P18054 1/20 0.42
THRB P10828 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL2322993 1.00 RAB9A (0.46) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL27873589 0.87 MAPT (0.49) ALDH1A1MAPTPOLBLMNAPKM
SCHEMBL2331792 0.87 RAB9A (0.43) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL27974448 0.87 RAB9A (0.43) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL7561830 0.85 RAB9A (0.47) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL679864 0.85 RAB9A (0.47) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL2327480 0.84 SMN1; SMN2 (0.44) RAB9ANPC1HPGDALDH1A1HTT
SCHEMBL8435071 0.83 PYGL (0.53) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL28130587 0.83 RAB9A (0.46) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL16340022 0.83 PYGL (0.53) RAB9ANPC1HPGDALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102215812-B Anti-wrinkle agents POLA CHEM IND INC 2014-09-10 CN disclosed
US-5136028-A Red; colorfastness CIBA-GEIGY CORPORATION (US) 1992-08-04 US disclosed
US-4283196-A FIXING BY ACTION OF AN ALKALINE AGENT AMERICAN HOECHST CORPORATION (US) 1981-08-11 US disclosed
US-4271072-A FIBER-REACTIVE, FOR DYEING NATURAL AND SYNTHETIC POLYAMIDES AND CELULOSES AMERICAN HOECHST CORPORATION (US) 1981-06-02 US disclosed