SCHEMBL31443230

SCHEMBL31443230

C=COC(=O)c1ccccc1C.COC(=O)c1ccccc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
ALDH1A1 P00352 3/20 0.47
CFTR P13569 1/20 0.47
HSD17B10 Q99714 1/20 0.47
KDM4E B2RXH2 3/20 0.47
MAPT P10636 2/20 0.47
KMT2A Q03164 2/20 0.47
ALOX12 P18054 1/20 0.47
POLB P06746 2/20 0.46
ATM Q13315 1/20 0.46
MYC P01106 1/20 0.45
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA5A P35218 1/20 0.42
CA9 Q16790 1/20 0.42
ALOX15 P16050 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
NR4A2 P43354 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
SCHEMBL182408 0.93 NPC1 (0.46) LMNATSHRALDH1A1MAPTKMT2A
SCHEMBL11794205 0.90 TSHR (0.55) LMNATSHRALDH1A1CFTRHSD17B10
Acetic Acid SCHEMBL27754846 0.88 NPC1 (0.46) LMNAALDH1A1HSD17B10KDM4EMAPT
SCHEMBL101601 0.86 TSHR (0.63) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL29702037 0.86 TSHR (0.63) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL15018447 0.84 TSHR (0.61) LMNATSHRALDH1A1CFTRHSD17B10
Hydrochloric Acid SCHEMBL17476094 0.84 TSHR (0.61) LMNATSHRALDH1A1CFTRHSD17B10
Water SCHEMBL27996142 0.84 TSHR (0.61) LMNATSHRALDH1A1CFTRHSD17B10
Benzene SCHEMBL28140196 0.84 TSHR (0.61) LMNATSHRALDH1A1CFTRHSD17B10
Acetic Acid SCHEMBL9262541 0.80 TSHR (0.57) LMNATSHRALDH1A1CFTRHSD17B10

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-119591771-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2025-03-11 CN claimed