SCHEMBL9715109

SCHEMBL9715109

C=C(CCc1ccccc1)C(=O)O.COc1ccc(C=C(C)C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
AKR1C3 P42330 1/20 0.48
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
PLAAT3 P53816 2/20 0.45
PLAAT5 Q96KN8 2/20 0.45
PLAAT2 Q9NWW9 2/20 0.45
PLAAT4 Q9UL19 2/20 0.45
ALDH1A1 P00352 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GPR52 Q9Y2T5 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL2563398 0.85 AKR1C3 (0.54) NPC1RAB9AAKR1C3MAPTLMNA
SCHEMBL9715111 0.82 AKR1C3 (0.53) NPC1RAB9AAKR1C3MAPTLMNA
SCHEMBL9715106 0.82 AKR1C3 (0.53) NPC1RAB9AAKR1C3MAPTLMNA
SCHEMBL1921185 0.81 F2RL1 (0.62) NPC1RAB9APLAAT3PLAAT5PLAAT2
SCHEMBL1237225 0.80 AKR1C3 (0.62) AKR1C3MAPTALDH1A1ATM
SCHEMBL20500020 0.80 AKR1C3 (0.62) AKR1C3MAPTALDH1A1ATM
SCHEMBL1237224 0.80 AKR1C3 (0.62) AKR1C3MAPTALDH1A1ATM
Hydrochloric Acid SCHEMBL9445568 0.78 AKR1C3 (0.60) AKR1C3MAPTALDH1A1ATM
Hydrochloric Acid SCHEMBL9445569 0.78 AKR1C3 (0.60) AKR1C3MAPTALDH1A1ATM
SCHEMBL1790765 0.78 RAB9A (0.44) NPC1RAB9AAKR1C3MAPTLMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0297285-B1 COMPATIBLE BLENDS OF POLYCARBONATE AND POLYMETHACRYLATE RÖHM GMBH (DE) 1992-10-14 EP disclosed
EP-0297285-A2 Compatible blends of polycarbonate and polymethacrylate Röhm GmbH (DE) 1989-01-04 EP disclosed