SCHEMBL4593857

SCHEMBL4593857

O=C(Nc1ccccc1Cl)c1cccc2c1C(=O)c1ccccc1-2

nearest known ligand 0.74

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.62
HPGD P15428 1/20 0.62
CYP2C19 P33261 1/20 0.62
CASP3 P42574 1/20 0.57
MAPT P10636 2/20 0.56
ALDH1A1 P00352 2/20 0.55
HTT P42858 1/20 0.55
LMNA P02545 1/20 0.54

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
SCHEMBL678962 0.85 ALDH1A1 (0.61) MAPTALDH1A1HTTLMNA
SCHEMBL4878832 0.84 HTT (0.61) MAPTALDH1A1HTTLMNA
SCHEMBL4586462 0.83 ALDH1A1 (0.58) MAPTALDH1A1HTTLMNA
SCHEMBL4586668 0.83 KMT2A (0.61) CYP1A2MAPTALDH1A1HTTLMNA
SCHEMBL4585958 0.83 ALDH1A1 (0.60) CYP1A2HPGDCYP2C19MAPTALDH1A1
SCHEMBL4586925 0.83 MAPT (0.56) MAPTALDH1A1HTTLMNA
SCHEMBL4585595 0.83 HTT (0.61) MAPTALDH1A1HTTLMNA
SCHEMBL11418929 0.82 CASP3 (0.76) CYP1A2HPGDCYP2C19CASP3MAPT
SCHEMBL4882682 0.82 CHRNB2 (0.64) CYP1A2CYP2C19MAPTALDH1A1HTT
SCHEMBL678335 0.81 MAPT (0.46) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080096848-A1 N-(2-(1H-Pyrazol-1-yl)-phenyl)-9H-fluorene-1-carboxamide for example; treating proliferative diseases such as cancer, viral diseases, inflammatory bowel disease, rheumatoid arthritis, psoriasis; combination therapy with other known anticancer drugs CYTOVIA INC. (CA) 2008-04-24 US claimed
EP-1804786-A4 SUBSTITUTED N-ARYL-9-OXO-9H-FLUORENE-1-CARBOXAMIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS CYTOVIA INC (US) 2008-01-02 EP claimed
EP-1804786-A2 SUBSTITUTED N-ARYL-9-OXO-9H-FLUORENE-1-CARBOXAMIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS Cytovia, Inc. (US) 2007-07-11 EP claimed
WO-2006039356-A2 SUBSTITUTED N-ARYL-9-OXO-9H-FLUORENE-1-CARBOXAMIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS CYTOVIA, INC. (US) 2006-04-13 WO claimed
US-20080096848-A1 N-(2-(1H-Pyrazol-1-yl)-phenyl)-9H-fluorene-1-carboxamide for example; treating proliferative diseases such as cancer, viral diseases, inflammatory bowel disease, rheumatoid arthritis, psoriasis; combination therapy with other known anticancer drugs CYTOVIA INC. (CA) 2008-04-24 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-20080096848-A1 N-(2-(1H-Pyrazol-1-yl)-phenyl)-9H-fluorene-1-carboxamide for example; treating proliferative diseases such as cancer, viral diseases, inflammatory bowel disease, rheumatoid arthritis, psoriasis; combination therapy with other known anticancer drugs CASP1, CASP9, CASP14 CYP1A2 381/4885HPGD 3273/4885CYP2C19 1099/4885

“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.