SCHEMBL8437208

SCHEMBL8437208

N#CCn1c(C(F)(F)F)nc2cc(Cl)c(Cl)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.36
ALDH1A1 P00352 4/20 0.35
DCTPP1 Q9H773 2/20 0.35
KDM4E B2RXH2 5/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
PPARG P37231 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
HPGD P15428 3/20 0.32
NPC1 O15118 2/20 0.32
LMNA P02545 2/20 0.32
MEN1 O00255 1/20 0.32
GLA P06280 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL1259443 0.80 AR (0.34) ARDCTPP1KDM4ELMNA
SCHEMBL13400201 0.77 DCTPP1 (0.52) ALDH1A1DCTPP1KDM4ETSHRCYP1A2
SCHEMBL8623725 0.77 KDM4E (0.50) ARALDH1A1DCTPP1KDM4EPPARG
SCHEMBL7750649 0.74 DCTPP1 (0.41) ALDH1A1DCTPP1KDM4EPPARGCYP1A2
SCHEMBL11485255 0.71 ALDH1A1 (0.40) ALDH1A1DCTPP1KDM4ETSHRPPARG
SCHEMBL14389903 0.67 RHEB (0.54) ALDH1A1KDM4ETSHRMAPK1CYP1A2
SCHEMBL11768622 0.67 CYP1A2 (0.36) ALDH1A1KDM4EPPARGCYP1A2CYP2D6
SCHEMBL10971739 0.66 KDM4E (0.48) DCTPP1KDM4ETSHRCYP1A2CYP2D6
SCHEMBL8697932 0.65 CYP2C9 (0.33) CYP1A2CYP2D6CYP2C9CYP2C19MEN1
SCHEMBL9436894 0.64 ALDH1A1 (0.56) ALDH1A1KDM4ETSHRMAPK1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5877195-A INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-03-02 US claimed
EP-0667863-B1 2-PERHALOGENALKYL-SUBSTITUTED BENZIMIDAZOLES, THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AG (DE) 1998-06-03 EP claimed
WO-1994011351-A1 2-PERHALOGENALKYL-SUBSTITUTED BENZIMIDAZOLES, THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1994-05-26 WO claimed
US-5877195-A INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-03-02 US disclosed
US-5877195-A INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-03-02 US disclosed
EP-0667863-B1 2-PERHALOGENALKYL-SUBSTITUTED BENZIMIDAZOLES, THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AG (DE) 1998-06-03 EP disclosed
EP-0667863-B1 2-PERHALOGENALKYL-SUBSTITUTED BENZIMIDAZOLES, THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AG (DE) 1998-06-03 EP disclosed
US-5482956-A ANTIPROTOZOA AGENTS FOR ANIMALS OR INSECTS BAYER AKTIENGESELLSCHAFT (DE) 1996-01-09 US disclosed
EP-0667863-A1 2-PERHALOGENALKYL-SUBSTITUTED BENZIMIDAZOLES, THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AG (DE) 1995-08-23 EP disclosed
WO-1994011351-A1 2-PERHALOGENALKYL-SUBSTITUTED BENZIMIDAZOLES, THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1994-05-26 WO disclosed
WO-1994011351-A1 2-PERHALOGENALKYL-SUBSTITUTED BENZIMIDAZOLES, THEIR PREPARATION AND THEIR USE AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1994-05-26 WO disclosed
EP-0597304-A1 Use of substituted benzimidazoles BAYER AG (DE) 1994-05-18 EP disclosed