SCHEMBL4783835

SCHEMBL4783835

CN1CCN(c2n[nH]c3cc(C(=O)NCc4ccc(Cl)cc4Cl)ccc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 6/20 0.53
LMNA P02545 2/20 0.52
MAPK1 P28482 1/20 0.47
NLRP1 Q9C000 1/20 0.47
EPHX2 P34913 6/20 0.47
MAPK8 P45983 1/20 0.44
ROCK2 O75116 2/20 0.44
ROCK1 Q13464 1/20 0.44
HDAC3 O15379 1/20 0.44
MTOR P42345 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44

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
SCHEMBL4784235 0.88 KMT2A (0.51) MAPK8HDAC3MTORHDAC1HDAC2
SCHEMBL4784193 0.82 DDR1 (0.51) DDR1LMNAMAPK1NLRP1EPHX2
SCHEMBL4781301 0.82 AURKA (0.54) MAPK1
SCHEMBL4785037 0.81 RAB9A (0.54) LMNAROCK2ROCK1HDAC1
SCHEMBL4783322 0.80 KMT2A (0.51) MAPK1MAPK8HDAC1
SCHEMBL4783741 0.79 KIT (0.52) LMNAMAPK8ROCK2
SCHEMBL4783423 0.78 KIT (0.51) EPHX2MAPK8HDAC1
SCHEMBL4784112 0.76 ALDH1A1 (0.54) MAPK1EPHX2MAPK8ROCK2
SCHEMBL4780938 0.75 MAPK1 (0.48) MAPK1
SCHEMBL4784771 0.75 LMNA (0.52) LMNAMAPK1NLRP1EPHX2MAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-06-26 US claimed
WO-2008061109-A2 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-05-22 WO claimed
US-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-06-26 US disclosed
US-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-06-26 US disclosed
US-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-06-26 US disclosed
WO-2008061109-A2 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-05-22 WO disclosed
WO-2008061109-A2 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-05-22 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 (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-20080153810-A1 INDAZOLE DERIVATIVES USEFUL AS MELANIN CONCENTRATING RECEPTOR LIGANDS MCHR1, MCHR2, MC1R DDR1 1750/4885LMNA 4549/4885MAPK1 3438/4885

“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.