SCHEMBL683675

SCHEMBL683675

CC(C)C(c1ccccc1)c1ccccc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.50
IDO1 P14902 1/20 0.43
TDO2 P48775 1/20 0.43
P2RX7 Q99572 1/20 0.42
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
OPRL1 P41146 1/20 0.40
HSD11B1 P28845 4/20 0.40
CNR2 P34972 1/20 0.39
CACNA2D1 P54289 1/20 0.38
CACNA1B Q00975 1/20 0.38
CACNB1 Q02641 1/20 0.38
CACNA1C Q13936 1/20 0.38
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MC4R P32245 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
SCHEMBL686397 0.81 ACP3 (0.53) ACP3IDO1TDO2P2RX7OPRM1
SCHEMBL12084494 0.78 ACP3 (0.50) ACP3IDO1TDO2P2RX7OPRM1
SCHEMBL23172133 0.76 P2RX7 (0.47) ACP3IDO1TDO2P2RX7HSD11B1
SCHEMBL13537951 0.76 P2RX7 (0.47) ACP3IDO1TDO2P2RX7HSD11B1
SCHEMBL2390807 0.76 ACP3 (0.56) ACP3IDO1TDO2P2RX7OPRM1
SCHEMBL84477 0.76 P2RX7 (0.50) ACP3IDO1TDO2P2RX7HSD11B1
SCHEMBL684363 0.75 IDO1 (0.47) IDO1TDO2OPRM1OPRD1OPRK1
SCHEMBL22391512 0.75 P2RX7 (0.50) ACP3IDO1TDO2P2RX7HSD11B1
SCHEMBL17069283 0.75 IDO1 (0.47) IDO1TDO2OPRM1OPRD1OPRK1
SCHEMBL29052941 0.75 ACP3 (0.54) ACP3IDO1TDO2P2RX7OPRM1

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-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF ACP3 233/4885IDO1 1319/4885TDO2 4111/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.