SCHEMBL28190831

SCHEMBL28190831

CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.50
TSHR P16473 3/20 0.44
THRB P10828 1/20 0.44
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
GBA1 P04062 1/20 0.37
MGLL Q99685 1/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 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
SCHEMBL14997773 1.00 DNM1 (0.50) DNM1TSHRTHRBCA12CA1
SCHEMBL26264322 1.00 DNM1 (0.50) DNM1TSHRTHRBCA12CA1
SCHEMBL10705836 1.00 DNM1 (0.50) DNM1TSHRTHRBCA12CA1
Nonane SCHEMBL28466423 1.00 DNM1 (0.50) DNM1TSHRTHRBCA12CA1
SCHEMBL26312931 1.00 DNM1 (0.50) DNM1TSHRTHRBCA12CA1
SCHEMBL14997774 1.00 DNM1 (0.50) DNM1TSHRTHRBCA12CA1
Hydrochloric Acid SCHEMBL6892416 0.97 DNM1 (0.52) DNM1TSHRTHRBCA12CA1
Hydrochloric Acid SCHEMBL6890708 0.97 DNM1 (0.52) DNM1TSHRTHRBCA12CA1
Hydrochloric Acid SCHEMBL6890293 0.97 DNM1 (0.52) DNM1TSHRTHRBCA12CA1
Hydrochloric Acid SCHEMBL6891923 0.97 DNM1 (0.52) DNM1TSHRTHRBCA12CA1

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-107510915-A A kind of oil-based drill cuttings destabilizing agent and preparation method thereof 中石化石油工程技术服务有限公司 2017-12-26 CN disclosed