SCHEMBL28099997

SCHEMBL28099997

CCCCCCCCC[CH]C(CC)CCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 1/20 0.38
DNM1 Q05193 4/20 0.37
FAAH O00519 2/20 0.37
TRPV1 Q8NER1 1/20 0.37
ADH1B P00325 1/20 0.36
ADH1C P00326 1/20 0.36
ADH1A P07327 1/20 0.36
ADH4 P08319 1/20 0.36
ADH7 P40394 1/20 0.36
THRB P10828 1/20 0.36
OPRM1 P35372 1/20 0.36

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
SCHEMBL418279 1.00 TSHR (0.46) TSHRSMN1; SMN2LMNADNM1FAAH
SCHEMBL27946898 1.00 TSHR (0.46) TSHRSMN1; SMN2LMNADNM1FAAH
SCHEMBL9777447 1.00 TSHR (0.46) TSHRSMN1; SMN2LMNADNM1FAAH
SCHEMBL10529071 1.00 TSHR (0.46) TSHRSMN1; SMN2LMNADNM1FAAH
SCHEMBL16097748 1.00 TSHR (0.46) TSHRSMN1; SMN2LMNADNM1FAAH
SCHEMBL10600803 0.98 TSHR (0.48) TSHRSMN1; SMN2LMNADNM1FAAH
SCHEMBL4053772 0.95 TSHR (0.52) TSHRSMN1; SMN2DNM1FAAHTRPV1
SCHEMBL1978740 0.95 TSHR (0.52) TSHRSMN1; SMN2DNM1FAAHTRPV1
SCHEMBL7501921 0.95 TSHR (0.52) TSHRSMN1; SMN2DNM1FAAHTRPV1
SCHEMBL6892024 0.95 TSHR (0.52) TSHRSMN1; SMN2DNM1FAAHTRPV1

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
CN-103619987-B Color converter 巴斯夫欧洲公司 2016-11-16 CN disclosed