SCHEMBL15845502

SCHEMBL15845502

O=[N+]([O-])c1ccccc1-c1cc2c(ccn2-c2ccccc2)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ FGFR1 P11362 2/20 0.38
▸ EIF4E P06730 7/20 0.37
▸ CFTR P13569 1/20 0.37
▸ PLA2G4A P47712 1/20 0.36
▸ DCTPP1 Q9H773 1/20 0.36
▸ BIRC5 O15392 1/20 0.35
▸ TUBB4A P04350 1/20 0.35
▸ TUBB P07437 1/20 0.35
▸ TUBA3C P0DPH7 1/20 0.35
▸ TUBA1B P68363 1/20 0.35
▸ TUBA4A P68366 1/20 0.35
▸ TUBB4B P68371 1/20 0.35
▸ TUBB3 Q13509 1/20 0.35
▸ TUBB2A Q13885 1/20 0.35
▸ TUBB8 Q3ZCM7 1/20 0.35
▸ TUBA3E Q6PEY2 1/20 0.35
▸ TUBA1A Q71U36 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
SCHEMBL15845441 0.95 HSD11B1 (0.44) HSD11B1ALDH1A1TDP1FGFR1EIF4E
SCHEMBL15845444 0.81 NPC1 (0.50) HSD11B1ALDH1A1TDP1CFTRDCTPP1
SCHEMBL15596380 0.80 ALDH1A1 (0.50) HSD11B1ALDH1A1TDP1FGFR1EIF4E
SCHEMBL15477945 0.80 ALDH1A1 (0.50) HSD11B1ALDH1A1TDP1FGFR1EIF4E
SCHEMBL15801770 0.78 ALDH1A1 (0.46) HSD11B1ALDH1A1TDP1FGFR1EIF4E
SCHEMBL15801671 0.78 ALDH1A1 (0.46) HSD11B1ALDH1A1TDP1FGFR1EIF4E
SCHEMBL15845592 0.78 HSD11B1 (0.41) HSD11B1ALDH1A1TDP1FGFR1EIF4E
SCHEMBL15845440 0.78 HSD11B1 (0.41) HSD11B1ALDH1A1TDP1FGFR1EIF4E
SCHEMBL17177972 0.77 ALDH1A1 (0.47) HSD11B1ALDH1A1TDP1FGFR1EIF4E
SCHEMBL15845453 0.77 ALDH1A1 (0.47) HSD11B1ALDH1A1TDP1FGFR1EIF4E

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
WO-2014104664-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 (KR) 2014-07-03 — — WO disclosed
WO-2014104664-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 (KR) 2014-07-03 — — WO disclosed
Send feedback