SCHEMBL8021385

SCHEMBL8021385

CCCc1nc2ccccc2n1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.59
LMNA P02545 2/20 0.59
POLB P06746 1/20 0.57
MAPK1 P28482 1/20 0.57
HTT P42858 1/20 0.57
PDE10A Q9Y233 4/20 0.56
CYP1A2 P05177 2/20 0.56
HCAR1 Q9BXC0 1/20 0.56
NTRK1 P04629 1/20 0.55
NTRK2 Q16620 1/20 0.55
TSHR P16473 1/20 0.52
HPGD P15428 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MEN1 O00255 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL10816806 0.90 MAPK1 (0.58) MAPTLMNAPOLBMAPK1HTT
SCHEMBL10818384 0.90 NTRK1 (0.56) MAPTLMNAPOLBMAPK1HTT
SCHEMBL10818398 0.89 POLB (0.54) MAPTLMNAPOLBMAPK1HTT
SCHEMBL541119 0.88 CETP (0.53) MAPTLMNAPOLBMAPK1HTT
Hydrochloric Acid SCHEMBL8024071 0.88 POLB (0.53) MAPTLMNAPOLBMAPK1HTT
SCHEMBL10812417 0.88 MAPT (0.50) MAPTLMNAPOLBMAPK1HTT
SCHEMBL12575336 0.88 CETP (0.53) MAPTLMNAPOLBMAPK1HTT
SCHEMBL11020420 0.88 CETP (0.53) MAPTLMNAPOLBMAPK1HTT
SCHEMBL762447 0.86 MAPK1 (0.66) MAPTPOLBMAPK1HTTPDE10A
SCHEMBL15081856 0.85 MAPK1 (0.54) MAPTLMNAPOLBMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021250279-A1 ORGANIC LIGHT EMITTING DIODE AND DEVICE COMPRISING THE SAME NOVALED GMBH (DE) 2021-12-16 WO disclosed
WO-2007046658-A1 NEW BINAPHTHALENE DERIVATIVES, PREPARATION METHOD THEREOF AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEM. LTD. (KR) 2007-04-26 WO disclosed
US-6030992-A ANTAGONISTS FOR THE BINDING OF NEUROKININ-2 RECEPTOR; SLEEP DISORDERS; BENZIMIDES, 2- OR 3-ALKOXYBENZIMIDES AND 2,3-DIALKOXYBENZIMIDES ELI LILLY AND COMPANY (US) 2000-02-29 US disclosed
US-6025379-A A SUBSTITUTED BENZIMIDAZOLE, TACHYKININ RECEPTOR ANTAGONISTS, ELI LILLY AND COMPANY (US) 2000-02-15 US disclosed
WO-1997033873-A1 METHODS OF TREATING OR PREVENTING INTERSTITIAL CYSTITIS ELI LILLY AND COMPANY (US) 1997-09-18 WO disclosed
WO-1997031635-A1 METHODS OF TREATING OR PREVENTING SLEEP APNEA ELI LILLY AND COMPANY (US) 1997-09-04 WO disclosed
US-5552426-A NERVOUS SYSTEM DISORDERS USING IMIDAZOLE DERIVITIVES ELI LILLY AND COMPANY (US) 1996-09-03 US disclosed
EP-0694535-A1 Non-peptidyl tachykinin receptor antagonists ELI LILLY AND COMPANY (US) 1996-01-31 EP disclosed
EP-0138750-B1 PROCESS FOR THE PRODUCTION OF SUBSTITUTED BENZIMIDAZOLES CIBA-GEIGY AG (CH) 1987-09-09 EP disclosed
EP-0138750-A1 Process for the production of substituted benzimidazoles CIBA-GEIGY AG (CH) 1985-04-24 EP disclosed