SCHEMBL4861526

SCHEMBL4861526

COc1ccc(CNc2ccccc2)cc1OC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.74
ALDH1A1 P00352 5/20 0.73
KDM4E B2RXH2 4/20 0.73
TDP1 Q9NUW8 3/20 0.73
GAA P10253 2/20 0.73
POLB P06746 1/20 0.69
LMNA P02545 3/20 0.64
L3MBTL1 Q9Y468 3/20 0.64
HPGD P15428 2/20 0.64
KMT2A Q03164 2/20 0.64
CA1 P00915 1/20 0.62
CA2 P00918 1/20 0.62
CA9 Q16790 1/20 0.62
SMN1; SMN2 Q16637 4/20 0.61
MRGPRX1 Q96LB2 2/20 0.61
F2 P00734 1/20 0.61
F10 P00742 1/20 0.61
PRSS1 P07477 1/20 0.61
F7 P08709 1/20 0.61
KIT P10721 1/20 0.56

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
SCHEMBL10119775 0.91 MAPT (0.74) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL3410940 0.89 MAPT (0.65) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL31192466 0.88 MRGPRX1 (0.74) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL10119743 0.88 MAPT (0.71) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL2711213 0.85 MAPT (0.68) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL16057469 0.85 GAA (0.64) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL28610112 0.85 MAPT (1.00) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL8065663 0.83 MAPT (0.74) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL28039966 0.83 MAPT (0.74) MAPTALDH1A1KDM4ETDP1GAA
SCHEMBL5309365 0.83 HIF1A (0.63) MAPTALDH1A1KDM4ETDP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9725439-B2 Quinazoline derivative and preparation method therefor CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2017-08-08 US disclosed
WO-2015043515-A1 QUINAZOLINE DERIVATIVE AND PREPARATION METHOD THEREFOR 正大天晴药业集团股份有限公司 2015-04-02 WO disclosed
US-7329761-B2 Substituted imides CELGENE CORPORATION (US) 2008-02-12 US disclosed
EP-0800514-B1 SUBSTITUTED IMIDES AS TNF INHIBITORS CELGENE CORP (US) 2006-08-23 EP disclosed
US-20050090516-A1 Novel substituted imides MULLER GEORGE W (US) 2005-04-28 US disclosed
US-6844359-B2 Substituted imides CELGENE CORPORATION (US) 2005-01-18 US disclosed
US-20020143027-A1 Novel substituted imides MULLER GEORGE W (US) 2002-10-03 US disclosed
US-6429221-B1 INHIBITORS OF TUMOR NECROSIS FACTOR; USED TO TREAT CACHEXIA, ENDOTOXIC SHOCK, AND RETROVIRUS REPLICATION CELGENE CORPORATION 2002-08-06 US disclosed
EP-0800514-A1 SUBSTITUTED IMIDES AS TNF INHIBITORS CELGENE CORPORATION (US) 1997-10-15 EP disclosed
WO-1996020926-A9 SUBSTITUTED IMIDES AS TNF INHIBITORS 1996-09-26 WO disclosed
WO-1996020926-A1 SUBSTITUTED IMIDES AS TNF INHIBITORS CELGENE CORPORATION (US) 1996-07-11 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-20020143027-A1 Novel substituted imides TNF, MIF, TNFRSF1A MAPT 4400/4885ALDH1A1 3516/4885KDM4E 276/4885
US-20050090516-A1 Novel substituted imides TNF, MIF, TNFRSF1A MAPT 4293/4885ALDH1A1 3735/4885KDM4E 241/4885

“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.