SCHEMBL8279069

SCHEMBL8279069

CC(=O)c1c(Cl)cccc1NC(=O)c1ccccc1Cl

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.68
▸ CYP1A2 P05177 1/20 0.68
▸ CYP2C19 P33261 1/20 0.68
▸ ALDH1A1 P00352 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ KDR P35968 1/20 0.55
▸ PABPC1 P11940 1/20 0.53
▸ EIF4H Q15056 1/20 0.53
▸ POLB P06746 1/20 0.51
▸ CASP3 P42574 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ PKM P14618 1/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.50
▸ PTGES O14684 1/20 0.49
▸ SLC16A3 O15427 1/20 0.49
▸ LMNA P02545 1/20 0.49

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
SCHEMBL13690053 0.88 HPGD (0.64) HPGDCYP1A2CYP2C19ALDH1A1MEN1
SCHEMBL13602368 0.85 PKM (0.49) HPGDCYP1A2CYP2C19ALDH1A1MEN1
SCHEMBL13602444 0.84 MAPT (0.58) HPGDCYP1A2CYP2C19ALDH1A1MEN1
SCHEMBL11594362 0.81 CYP1A2 (0.68) HPGDCYP1A2CYP2C19ALDH1A1MEN1
SCHEMBL31087272 0.81 NPC1 (0.59) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL13689825 0.79 ALDH1A1 (0.43) HPGDCYP1A2CYP2C19ALDH1A1MEN1
SCHEMBL11155741 0.78 PBRM1 (0.58) HPGDCYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL28729711 0.77 CYP1A2 (0.53) HPGDCYP1A2CYP2C19ALDH1A1MEN1
SCHEMBL9833874 0.77 CYP1A2 (0.77) HPGDCYP1A2CYP2C19ALDH1A1MEN1
SCHEMBL1514283 0.77 HPGD (0.77) HPGDCYP1A2CYP2C19ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325962-A1 TYROSINE DERIVATIVE GENENTECH, INC. (US) 2009-12-31 — — US disclosed
US-20090325962-A1 TYROSINE DERIVATIVE GENENTECH, INC. (US) 2009-12-31 — — US disclosed
US-7595399-B2 Tyrosine derivatives GENENTECH, INC. (US) 2009-09-29 — — US disclosed
US-7595399-B2 Tyrosine derivatives GENENTECH, INC. (US) 2009-09-29 — — US disclosed
US-20080075719-A1 Method for Augmenting B Cell Depletion GENENTECH, INC. (US) 2008-03-27 — — US disclosed
US-20080075719-A1 Method for Augmenting B Cell Depletion GENENTECH, INC. (US) 2008-03-27 — — US disclosed
EP-1214292-B1 TYROSINE DERIVATIVES GENENTECH INC (US) 2007-06-13 — — EP disclosed
WO-2005113003-A2 METHOD FOR AUGMENTING B CELL DEPLETION GENENTECH, INC. (US) 2005-12-01 — — 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 (2 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-20090325962-A1 TYROSINE DERIVATIVE VCAM1, ICAM1, ITGB4 HPGD 3620/4885CYP1A2 2883/4885CYP2C19 2320/4885
US-20080075719-A1 Method for Augmenting B Cell Depletion CD22, ITGAM, FCGR3B HPGD 3099/4885CYP1A2 3933/4885CYP2C19 4671/4885

“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.

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