SCHEMBL11638630

SCHEMBL11638630

CCCCCCC(=O)Nc1cccc([S])c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
POLB P06746 1/20 0.59
SOAT2 O75908 1/20 0.59
SOAT1 P35610 1/20 0.59
KDM4E B2RXH2 1/20 0.58
HDAC3 O15379 4/20 0.57
HDAC1 Q13547 4/20 0.57
HDAC2 Q92769 4/20 0.57
HDAC10 Q969S8 4/20 0.57
HDAC11 Q96DB2 4/20 0.57
HDAC8 Q9BY41 4/20 0.57
HDAC6 Q9UBN7 4/20 0.57
NCOR2 Q9Y618 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C19 P33261 1/20 0.57
ALDH1A1 P00352 1/20 0.56

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
SCHEMBL11864941 0.98 LMNA (0.62) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL11901010 0.89 LMNA (0.69) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL9115650 0.85 HDAC3 (0.78) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL21234556 0.85 HDAC4 (0.65) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL8388528 0.85 HDAC4 (0.65) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL8741843 0.85 HDAC4 (0.65) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL28732582 0.85 HDAC4 (0.65) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL10969527 0.84 KDM4E (0.72) LMNANPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL4135856 0.84 MEN1 (0.64) LMNANPC1RAB9ASMN1; SMN2POLB
SCHEMBL9168407 0.84 HDAC3 (0.78) LMNANPC1RAB9ASMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4108663-A MULTILAYER FUJI PHOTO FILM CO., LTD. (JP) 1978-08-22 US disclosed