SCHEMBL900362

SCHEMBL900362

Cc1cc(Cl)c2ccc(C(F)(F)F)cc2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.49
C1R P00736 1/20 0.44
NR4A2 P43354 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
GAK O14976 1/20 0.41
KDM4E B2RXH2 2/20 0.40
PARP1 P09874 1/20 0.40
PDE2A O00408 3/20 0.39
F7 P08709 1/20 0.39
F3 P13726 1/20 0.39
PDE10A Q9Y233 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NLRP3 Q96P20 1/20 0.38

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
SCHEMBL5101813 0.87 LMNA (0.62) MAPTLMNAPOLBGAKPDE2A
SCHEMBL3826784 0.83 NT5E (0.54) LMNAC1RKDM4EPARP1PDE2A
SCHEMBL23066252 0.83 C1R (0.46) LMNAC1RKDM4EPARP1PDE2A
SCHEMBL8396844 0.81 C1R (0.45) LMNAC1RKDM4EPARP1PDE2A
SCHEMBL899555 0.80 KDM4E (0.47) POLBL3MBTL1GAKKDM4EPARP1
SCHEMBL9493259 0.80 C1R (0.50) LMNAC1RKDM4EPARP1F7
SCHEMBL858917 0.77 MAPT (0.56) MAPTLMNAPOLBNR4A2L3MBTL1
SCHEMBL4745343 0.77 POLB (0.72) MAPTLMNAPOLBNR4A2L3MBTL1
SCHEMBL29636633 0.77 C1R (0.41) LMNAPOLBC1RKDM4EPARP1
SCHEMBL23040982 0.77 C1R (0.41) LMNAPOLBC1RKDM4EPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2621923-B1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES INTERVET INT BV (NL) 2017-03-29 EP disclosed
US-8883791-B2 N-heteroaryl compounds with cyclic bridging unit for the treatment of parasitic diseases INTERVET INC. (US) 2014-11-11 US disclosed
US-20130203768-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES INTERVET INC. 2013-08-08 US disclosed
EP-2621923-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES Intervet International B.V. (NL) 2013-08-07 EP disclosed
WO-2012041872-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES INTERVET INTERNATIONAL B.V. (NL) 2012-04-05 WO disclosed
US-20090018163-A1 Substituted Heterocyclic Ethers and Their Use in CNS Disorders BRISTOL-MYERS SQUIBB COMPANY 2009-01-15 US disclosed
WO-2009009633-A1 SUBSTITUTED HETEROCYCLIC ETHERS AND THEIR USE IN CNS DISORDERS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-15 WO disclosed
EP-1082297-A1 SUBSTITUTED DITHIO-BIS-NITROBENZENES AND THEIR APPLICATIONS INSTITUT PASTEUR DE LILLE (FR) 2001-03-14 EP disclosed
WO-1999061416-A1 SUBSTITUTED DITHIO-BIS-NITROBENZENES AND THEIR APPLICATIONS INSTITUT PASTEUR DE LILLE (FR) 1999-12-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090018163-A1 Substituted Heterocyclic Ethers and Their Use in CNS Disorders CNR1, CNR2, PMP22 MAPT 131/4885LMNA 2814/4885POLB 4828/4885
US-20130203768-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES PIGO, HNMT, PIGS MAPT 3171/4885LMNA 981/4885POLB 2010/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.