SCHEMBL9419742

SCHEMBL9419742

N#CCc1cc(Cc2ccc(Cl)cc2)c(N)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ CYP2A6 P11509 1/20 0.37
▸ HSP90AB1 P08238 1/20 0.36
▸ MPO P05164 1/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ ADCY10 Q96PN6 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ P2RX3 P56373 1/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32
▸ HRH1 P35367 1/20 0.32
▸ HTR2B P41595 1/20 0.32
▸ CHRNA4 P43681 1/20 0.32
▸ SLC6A3 Q01959 1/20 0.32
▸ TSHR P16473 3/20 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
SCHEMBL11765293 0.81 MAPT (0.42) MAPTMEN1KMT2ACYP2A6HSP90AB1
SCHEMBL9364439 0.74 SLC6A4 (0.41) MAPTMEN1KMT2ACYP2A6CYP3A4
SCHEMBL28307656 0.73 CYP2A6 (0.49) MAPTMEN1KMT2ACYP2A6CYP3A4
Ammonia Solution, Strong SCHEMBL28306691 0.72 CYP2A6 (0.47) MAPTMEN1KMT2ACYP2A6CYP3A4
SCHEMBL10636834 0.71 HTR2A (0.34) MAPTMEN1KMT2ACYP2A6HSP90AB1
SCHEMBL8993309 0.70 MAPT (0.41) MAPTMEN1KMT2ACYP2A6HSP90AB1
SCHEMBL8042022 0.70 CYP2A6 (0.49) MAPTMEN1KMT2ACYP2A6CYP3A4
SCHEMBL2581205 0.69 CYP2A6 (0.51) MAPTMEN1KMT2ACYP2A6CYP3A4
SCHEMBL29457615 0.69 CYP1A2 (0.57) MAPTCYP2A6CYP3A4SMN1; SMN2TP53
SCHEMBL549082 0.69 CYP1A2 (0.57) MAPTCYP2A6CYP3A4SMN1; SMN2TP53

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-0617892-A1 A veterinary medicament for preventive treatment and therapy of cattle against parasites HAK PHARMA B.V. (NL) 1994-10-05 — — EP disclosed
EP-0272706-B1 METHOD FOR MANUFACTURING A VETERINARY MEDICINE, AND PROCESS FOR PUTTING IT INTO PHARMACEUTICALLY APPLICABLE FORMS Hak, Barend Willem (NL) 1992-10-28 — — EP disclosed
EP-0272706-A2 Method for manufacturing a veterinary medicine, and process for putting it into pharmaceutically applicable forms Hak, Barend Willem (NL) 1988-06-29 — — EP disclosed
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