SCHEMBL7093937

SCHEMBL7093937

Oc1cccc2cc3c(nc12)CCCC3

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.43
BAD Q92934 1/20 0.43
PRNP P04156 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
KDM4E B2RXH2 5/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
METAP2 P50579 2/20 0.41
PLAU P00749 1/20 0.41
NCF1 P14598 1/20 0.41
PIM1 P11309 1/20 0.40
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.40

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
SCHEMBL9240088 0.98 BCL2L1 (0.42) BCL2L1BADPRNPRXFP1KDM4E
SCHEMBL10416253 0.98 BCL2L1 (0.42) BCL2L1BADPRNPRXFP1KDM4E
SCHEMBL10695816 0.89 KMT2A (0.44) KDM4EMEN1KMT2AMETAP2PLAU
SCHEMBL29496067 0.79 PRNP (0.58) PRNPRXFP1ALDH1A1NPC1ACHE
SCHEMBL3792562 0.79 PRNP (0.42) PRNPRXFP1KDM4EKMT2AALDH1A1
SCHEMBL15886676 0.79 PRNP (0.52) PRNPRXFP1KDM4EALDH1A1NPC1
SCHEMBL19618086 0.77 PIM1 (0.47) KDM4EMEN1KMT2AMETAP2PLAU
SCHEMBL29496040 0.76 RXFP1 (0.63) PRNPRXFP1KDM4EALDH1A1NPC1
SCHEMBL9559130 0.76 NPC1 (0.43) PRNPRXFP1KDM4EALDH1A1NPC1
SCHEMBL9406712 0.76 RXFP1 (0.40) PRNPRXFP1KDM4EALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1280771-A2 NOVEL PRODRUGS VON 6-HYDROXY-2,3-DIHYDRO-1H-INDOLES, 5-HYDROXY-1,2-DIHYDRO-3H-PYRROLO 3,2-E]INDOLES AND 5-HYDROXY-1,2-DIHYDRO-3H-BENZO(E)INDOLES AS WELL AS OF 6-HYDROXY-1,2,3,4-TETRAHYDRO-BENZO F]QUINOLINE DERIVATIVES FOR USE IN SELECTIVE CANCER THERAPY Tietze, Lutz F., Prof. Dr. (DE) 2003-02-05 EP disclosed
WO-2001083448-A2 NOVEL PRODRUGS VON 6-HYDROXY-2,3-DIHYDRO-1H-INDOLES, 5-HYDROXY-1,2-DIHYDRO-3H-PYRROLO[3,2-E]INDOLES AND 5-HYDROXY-1,2-DIHYDRO-3H-BENZO(E)INDOLES AS WELL AS OF 6-HYDROXY-1,2,3,4-TETRAHYDRO-BENZO[F]QUINOLINE DERIVATIVES FOR USE IN SELECTIVE CANCER THERAPY TIETZE LUTZ F (DE) 2001-11-08 WO disclosed
US-5468825-A Coating composition for carriers for use in electrophotography and carriers using the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 1995-11-21 US disclosed