SCHEMBL4282268

SCHEMBL4282268

O=C(O)CN(Cc1ccccc1)c1ccc(F)c(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43
PTGIR P43119 1/20 0.42
PPARG P37231 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 1/20 0.41
NR3C1 P04150 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
PTPN1 P18031 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
S1PR1 P21453 1/20 0.40

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
SCHEMBL4277272 0.85 PTPN1 (0.43) ALDH1A1CRHBPCRHR2PPARGNPC1
SCHEMBL13657714 0.83 ALDH1A1 (0.46) ALDH1A1CRHBPCRHR2LMNAPTGIR
SCHEMBL264790 0.80 PTPN1 (0.52) CRHBPCRHR2MEN1KMT2ANR3C1
SCHEMBL5189401 0.78 TSHR (0.57) ALDH1A1CRHBPCRHR2LMNAPOLB
SCHEMBL4626128 0.76 CYP2C19 (0.41) ALDH1A1CRHBPCRHR2LMNAMEN1
SCHEMBL7085600 0.76 CRHBP (0.51) CRHBPCRHR2PPARGMEN1KMT2A
SCHEMBL20323088 0.76 ALDH1A1 (0.55) ALDH1A1PTGIRKMT2ANPC1RAB9A
SCHEMBL4272539 0.76 NR1H4 (0.41) ALDH1A1LMNAPKMPTGIRPPARG
SCHEMBL4268261 0.76 UBE2M (0.43) ALDH1A1LMNAPTGIRPPARGMEN1
SCHEMBL4268265 0.76 UBE2M (0.43) ALDH1A1LMNAPTGIRPPARGMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7608739-B2 Mitotic kinesin inhibitors MERCK & CO. INC. (US) 2009-10-27 US claimed
US-20080234281-A1 Mitotic Kinesin Inhibitors MERCK SHARP & DOHME CORP. 2008-09-25 US claimed
EP-1730099-A4 MITOTIC KINESIN INHIBITORS MERCK & CO INC (US) 2008-03-12 EP claimed
CN-1934066-A Mitotic kinesin inhibitors MERCK & CO INC (US) 2007-03-21 CN claimed
EP-1730099-A2 MITOTIC KINESIN INHIBITORS Merck & Co., Inc. (US) 2006-12-13 EP claimed
WO-2005092011-A2 MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2005-10-06 WO claimed
US-7608739-B2 Mitotic kinesin inhibitors MERCK & CO. INC. (US) 2009-10-27 US disclosed
US-7608739-B2 Mitotic kinesin inhibitors MERCK & CO. INC. (US) 2009-10-27 US disclosed
US-7608739-B2 Mitotic kinesin inhibitors MERCK & CO. INC. (US) 2009-10-27 US disclosed
US-20080234281-A1 Mitotic Kinesin Inhibitors MERCK SHARP & DOHME CORP. 2008-09-25 US disclosed
US-20080234281-A1 Mitotic Kinesin Inhibitors MERCK SHARP & DOHME CORP. 2008-09-25 US disclosed
US-20080234281-A1 Mitotic Kinesin Inhibitors MERCK SHARP & DOHME CORP. 2008-09-25 US disclosed
EP-1730099-A4 MITOTIC KINESIN INHIBITORS MERCK & CO INC (US) 2008-03-12 EP disclosed
CN-1934066-A Mitotic kinesin inhibitors MERCK & CO INC (US) 2007-03-21 CN disclosed
EP-1730099-A2 MITOTIC KINESIN INHIBITORS Merck & Co., Inc. (US) 2006-12-13 EP disclosed
WO-2005092011-A2 MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2005-10-06 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-20080234281-A1 Mitotic Kinesin Inhibitors KIF5B, KIF2C, KIF18B ALDH1A1 2691/4885CRHBP 3681/4885CRHR2 4785/4885

“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.