SCHEMBL2019463

SCHEMBL2019463

CCCN(CCC)c1nnc(-c2ccccc2C)c2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 14/20 0.45
MAPT P10636 1/20 0.42
SMO Q99835 1/20 0.38
ADORA2A P29274 1/20 0.37
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
AGTR1 P30556 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
ALOX15 P16050 1/20 0.36
CREBBP Q92793 1/20 0.36

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
SCHEMBL2016941 0.87 CRHR1 (0.47) CRHR1
SCHEMBL2016277 0.84 CRHR1 (0.44) CRHR1MAPTMEN1NPC1AGTR1
SCHEMBL2015379 0.84 CRHR1 (0.60) CRHR1MAPTSMO
SCHEMBL2019659 0.80 CRHR1 (0.51) CRHR1
SCHEMBL2018746 0.78 CRHR1 (0.46) CRHR1
SCHEMBL2019281 0.78 METAP2 (0.46) CRHR1MAPTCREBBP
SCHEMBL2025212 0.78 CRHR1 (0.42) CRHR1
SCHEMBL2017785 0.76 CRHR1 (0.67) CRHR1
SCHEMBL12750274 0.75 CRHR1 (0.76) CRHR1
SCHEMBL2015228 0.74 CRHR1 (0.43) CRHR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338591-B2 3-aryl-5,6-disubstituted pyridazines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2012-12-25 US claimed
US-8338591-B2 3-aryl-5,6-disubstituted pyridazines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2012-12-25 US disclosed
US-8338591-B2 3-aryl-5,6-disubstituted pyridazines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2012-12-25 US disclosed
US-20110160187-A1 3-aryl-5,6-disubstituted pyridazines NEUROGEN CORPORATION (US) 2011-06-30 US disclosed
US-20110160187-A1 3-aryl-5,6-disubstituted pyridazines NEUROGEN CORPORATION (US) 2011-06-30 US disclosed
US-20110160187-A1 3-aryl-5,6-disubstituted pyridazines NEUROGEN CORPORATION (US) 2011-06-30 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-20110160187-A1 3-aryl-5,6-disubstituted pyridazines MMP25, MMP9, MMP3 CRHR1 2714/4885MAPT 3362/4885SMO 1379/4885

“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.