SCHEMBL1877422

SCHEMBL1877422

Fc1ccc(CNc2cc(N3CCNCC3)nnc2C(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 1/20 0.44
HTR6 P50406 4/20 0.39
MAOB P27338 2/20 0.39
ADRB1 P08588 1/20 0.39
DPP4 P27487 2/20 0.39
HRH4 Q9H3N8 2/20 0.39
HRH3 Q9Y5N1 1/20 0.39
MET P08581 2/20 0.39
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CTNNB1 P35222 2/20 0.36
TCF7L2 Q9NQB0 2/20 0.36
SOS1 Q07889 1/20 0.36
HTR3A P46098 1/20 0.35
ADRB2 P07550 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
SCHEMBL1880939 0.82 BPTF (0.58) BPTFHTR6ADRB1DPP4HTR3A
SCHEMBL12635646 0.78 DNMT3A (0.49) METKDM4EMEN1HTTKMT2A
SCHEMBL1579592 0.77 PRMT5 (0.45) BPTFHTR6ADRB1
SCHEMBL2957583 0.76 HTR7 (0.48) BPTFHTR6ADRB1HRH4HRH3
SCHEMBL2955161 0.75 HTR7 (0.47) BPTFHTR6ADRB1HRH4HRH3
SCHEMBL1580030 0.73 SLC6A2 (0.52) BPTFADRB1ADRB2
SCHEMBL1579254 0.72 BPTF (0.43) BPTFHTR6MAOBADRB1HTR3A
SCHEMBL1579251 0.72 BPTF (0.43) BPTFHTR6MAOBADRB1HTR3A
SCHEMBL1579440 0.72 BPTF (0.43) BPTFHTR6MAOBADRB1HTR3A
SCHEMBL1579929 0.72 ADRB1 (0.43) BPTFHTR6ADRB1HRH4HRH3

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
CN-102159554-B Substituted 6- (1-piperazinyl) -pyridazines as 5-ht6 receptor antagonists JANSSEN PHARMACEUTICA NV 2014-09-24 CN disclosed
US-8530474-B2 Substituted 6-(1-piperazinyl)-pyridazines as 5-HT6 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2013-09-10 US disclosed
US-8530474-B2 Substituted 6-(1-piperazinyl)-pyridazines as 5-HT6 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2013-09-10 US disclosed
US-8530474-B2 Substituted 6-(1-piperazinyl)-pyridazines as 5-HT6 receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2013-09-10 US disclosed
EP-2310374-B1 SUBSTITUTED 6- (1-PIPERAZINYL) -PYRIDAZINES AS 5-HT6 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2012-10-31 EP disclosed
CN-102159554-A Substituted 6- (1-piperazinyl) -pyridazines as 5-ht6 receptor antagonists JANSSEN PHARMACEUTICA NV 2011-08-17 CN disclosed
US-20110112107-A1 SUBSTITUTED 6-(1-PIPERAZINYL)-PYRIDAZINES AS 5-HT6 RECEPTOR ANTAGONISTS JANSSEN-CILAG S.A. (ES) 2011-05-12 US disclosed
US-20110112107-A1 SUBSTITUTED 6-(1-PIPERAZINYL)-PYRIDAZINES AS 5-HT6 RECEPTOR ANTAGONISTS JANSSEN-CILAG S.A. (ES) 2011-05-12 US disclosed
US-20110112107-A1 SUBSTITUTED 6-(1-PIPERAZINYL)-PYRIDAZINES AS 5-HT6 RECEPTOR ANTAGONISTS JANSSEN-CILAG S.A. (ES) 2011-05-12 US 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 (1 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-20110112107-A1 SUBSTITUTED 6-(1-PIPERAZINYL)-PYRIDAZINES AS 5-HT6 RECEPTOR ANTAGONISTS HTR6, HTR5A, HTR1A BPTF 2547/4885HTR6 1/4885MAOB 223/4885

“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.