SCHEMBL11414048

SCHEMBL11414048

Cc1ccc(NO)cc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.54
▸ ALDH1A1 P00352 2/20 0.48
▸ HDAC1 Q13547 2/20 0.47
▸ HDAC7 Q8WUI4 2/20 0.47
▸ HDAC8 Q9BY41 2/20 0.47
▸ HDAC6 Q9UBN7 2/20 0.47
▸ HDAC3 O15379 1/20 0.47
▸ HDAC4 P56524 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ HDAC10 Q969S8 1/20 0.47
▸ HDAC11 Q96DB2 1/20 0.47
▸ HDAC9 Q9UKV0 1/20 0.47
▸ HDAC5 Q9UQL6 1/20 0.47
▸ MAPT P10636 4/20 0.44
▸ NPC1 O15118 4/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ GAA P10253 1/20 0.44

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
SCHEMBL6653675 0.80 ALDH1A1 (0.50) ALDH1A1MAPTNPC1RAB9ALMNA
SCHEMBL11404540 0.78 KMT2A (0.50) POLBALDH1A1HDAC1HDAC6MAPT
SCHEMBL12064898 0.78 TDP1 (0.50) POLBALDH1A1MAPTNPC1RAB9A
SCHEMBL11408434 0.78 RAPGEF4 (0.55) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL11820221 0.78 NPC1 (0.44) ALDH1A1MAPTNPC1SMN1; SMN2LMNA
SCHEMBL22966294 0.78 MEN1 (0.36) POLBALDH1A1HDAC1HDAC7HDAC8
SCHEMBL1155655 0.78 ALDH1A1 (0.53) POLBALDH1A1MAPTNPC1RAB9A
SCHEMBL9226189 0.78 POLB (0.52) POLBALDH1A1MAPTNPC1RAB9A
SCHEMBL31549984 0.78 ALDH1A1 (0.53) POLBALDH1A1MAPTNPC1RAB9A
SCHEMBL30508518 0.78 ALDH1A1 (0.53) POLBALDH1A1MAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4224340-A Anti-inflammatory compositions containing α-phenyl-N-phenylnitrone compounds WILLIAM H. RORER, INC. (US) 1980-09-23 — — US disclosed
US-4214003-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1980-07-22 — — US disclosed
US-4197314-A WITH A DIPHENYL NITRONE WILLIAM H. RORER, INC. (US) 1980-04-08 — — US disclosed
US-4168279-A Manufacture of amines of the formula Ar--NH--CH2 --R BASF AKTIENGESELLSCHAFT (DE) 1979-09-18 — — US disclosed
US-4153722-A ANTIINFLAMMATORY, A-PHENYL-N-PHENYLNITRONE WILLIAM H. RORER, INC. (US) 1979-05-08 — — US disclosed
US-3982922-A Herbicidal compositions containing furancarboxamides VELSICOL CHEMICAL CORPORATION (US) 1976-09-28 — — US disclosed
US-3944410-A Substituted oxadiazolidine dione herbicides VELSICOL CHEMICAL CORPORATION (US) 1976-03-16 — — US disclosed
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