SCHEMBL8349679

SCHEMBL8349679

C=C(/C=C\c1ccccc1C)CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ TSHR P16473 2/20 0.41
▸ KDM4E B2RXH2 3/20 0.39
▸ APOBEC3A P31941 1/20 0.39
▸ APOBEC3G Q9HC16 1/20 0.39
▸ PTGER1 P34995 1/20 0.38
▸ PTGER4 P35408 1/20 0.38
▸ PTGER3 P43115 1/20 0.38
▸ PTGER2 P43116 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ PABPC1 P11940 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ IAPP P10997 1/20 0.37
▸ CYP1A2 P05177 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ THPO P40225 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ NR1H2 P55055 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
SCHEMBL903372 0.85 RAB9A (0.41) RAB9AALDH1A1TSHRKDM4EAPOBEC3A
SCHEMBL26539118 0.81 ALDH1A1 (0.43) RAB9AALDH1A1TSHRKDM4EAPOBEC3A
SCHEMBL12800400 0.79 MEN1 (0.39) RAB9AALDH1A1TSHRKDM4EAPOBEC3A
SCHEMBL8859640 0.79 ALDH1A1 (0.45) RAB9AALDH1A1TSHRKDM4EAPOBEC3A
SCHEMBL8349013 0.79 TSHR (0.45) RAB9AALDH1A1TSHRKDM4EAPOBEC3A
SCHEMBL2961735 0.79 TSHR (0.45) RAB9AALDH1A1TSHRKDM4EAPOBEC3A
SCHEMBL13287300 0.78 IAPP (0.60) RAB9AALDH1A1TSHRKDM4EPTGER1
SCHEMBL27832643 0.78 IAPP (0.60) RAB9AALDH1A1TSHRKDM4EPTGER1
SCHEMBL3362442 0.78 IAPP (0.60) RAB9AALDH1A1TSHRKDM4EPTGER1
SCHEMBL2476699 0.78 IAPP (0.60) RAB9AALDH1A1TSHRKDM4EPTGER1

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
WO-2003030886-A2 ALLYLAMIDES USEFUL IN THE TREATMENT OF ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC (US) 2003-04-17 — — WO disclosed
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