SCHEMBL25638939

SCHEMBL25638939

CC/C=C\C=C(/CC)N(C)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.41
▸ PHGDH O43175 1/20 0.41
▸ MGLL Q99685 1/20 0.41
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ TSHR P16473 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33

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
SCHEMBL12411240 0.79 FAAH (0.41) FAAHPHGDHMGLLCA12CA1
SCHEMBL20414287 0.78 FAAH (0.44) FAAHPHGDHMGLLCA12CA1
SCHEMBL20081454 0.71 KMT2A (0.41) FAAHPHGDHMGLLCA12CA1
SCHEMBL21374077 0.70 NPSR1 (0.34) FAAHPHGDHMGLLALDH1A1NPC1
SCHEMBL21913825 0.69 FAAH (0.39) FAAHPHGDHMGLLCA12CA1
SCHEMBL12411241 0.68 TP53 (0.44) FAAHPHGDHMGLLCA12CA1
SCHEMBL12116607 0.67 ATM (0.38) CA12CA1CA2CA9ALDH1A1
SCHEMBL6909714 0.66 FAAH (0.47) FAAHPHGDHMGLLCA12CA1
SCHEMBL18745499 0.66 KDM1A (0.38) ALDH1A1LMNAL3MBTL1KDM4E
SCHEMBL25645809 0.66 FAAH (0.43) FAAHPHGDHMGLLCA12CA1

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-20230200207-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2023-06-22 — — US disclosed
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