SCHEMBL2019402

SCHEMBL2019402

CCN(Cc1ccccc1)c1nnc(-c2ccccc2Cl)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.43
RXFP1 Q9HBX9 1/20 0.43
TSHR P16473 1/20 0.42
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
TSPO P30536 1/20 0.39
CNR2 P34972 2/20 0.38
CNR1 P21554 1/20 0.38
SMO Q99835 1/20 0.37
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
KMT2A Q03164 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
SCHEMBL2022708 0.81 CYP1A2 (0.40) TSHRTP53MAPTCNR2NR1H2
SCHEMBL2015379 0.81 CRHR1 (0.60) CRHR1RXFP1MAPTSMO
SCHEMBL2017613 0.77 PDK1 (0.41) CRHR1TSHRTP53MAPTCNR2
SCHEMBL2046515 0.77 CRHR1 (0.46) CRHR1TSHRTP53MAPTCNR2
SCHEMBL6973837 0.73 CRHR1 (0.39) CRHR1TSHRCNR2CNR1KMT2A
SCHEMBL6964070 0.72 CRHR1 (0.38) CRHR1MAPT
SCHEMBL2017361 0.70 SMO (0.38) CRHR1TSHRMAPTTSPOSMO
SCHEMBL2024570 0.67 LMNA (0.48) CRHR1MAPTCNR2CNR1
SCHEMBL2019463 0.66 CRHR1 (0.45) CRHR1MAPTSMOKMT2A
SCHEMBL1083853 0.65 ACP1 (0.67) RXFP1TSHRTP53MAPTTSPO

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 2714/4885RXFP1 1527/4885TSHR 3648/4885

“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.