SCHEMBL13337768

SCHEMBL13337768

OCCc1nc2ccccc2n1CCO

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.64
▸ HPGD P15428 1/20 0.64
▸ POLB P06746 2/20 0.62
▸ CYP1A2 P05177 1/20 0.59
▸ CYP3A4 P08684 1/20 0.59
▸ CYP2D6 P10635 1/20 0.59
▸ CYP2C19 P33261 1/20 0.59
▸ ALDH1A1 P00352 2/20 0.58
▸ KMT2A Q03164 2/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ LMNA P02545 2/20 0.56
▸ MAPT P10636 1/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ TSHR P16473 2/20 0.53
▸ PKM P14618 1/20 0.53
▸ RECQL P46063 1/20 0.53
▸ APEX1 P27695 1/20 0.53
▸ NPC1 O15118 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ RAB9A P51151 1/20 0.51

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
SCHEMBL3750821 0.89 POLB (0.80) KDM4EPOLBALDH1A1KMT2AMEN1
SCHEMBL9597872 0.89 MAPT (0.64) KDM4EHPGDPOLBALDH1A1KMT2A
SCHEMBL1520195 0.88 POLB (0.73) KDM4EHPGDPOLBCYP1A2CYP3A4
SCHEMBL9597597 0.86 POLB (0.67) HPGDPOLBALDH1A1KMT2AMEN1
SCHEMBL11195872 0.85 TSHR (0.68) KDM4EHPGDPOLBCYP1A2CYP3A4
SCHEMBL9598289 0.85 PKM (0.68) KDM4ECYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL9597357 0.85 TP53 (0.65) POLBALDH1A1KMT2AMEN1LMNA
SCHEMBL9598599 0.84 TP53 (0.63) POLBALDH1A1KMT2AMEN1LMNA
SCHEMBL9597876 0.81 LMNA (0.59) KDM4EHPGDPOLBALDH1A1KMT2A
SCHEMBL11743461 0.81 KDM4E (0.58) KDM4EHPGDPOLBCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2384457-B1 COATING COMPOSITIONS MERCK PATENT GMBH (DE) 2022-07-06 — — EP disclosed
US-9146467-B2 Coating compositions MERCK PATENT GMBH (DE) 2015-09-29 — — US disclosed
US-9146467-B2 Coating compositions MERCK PATENT GMBH (DE) 2015-09-29 — — US disclosed
US-20130236833-A1 COATING COMPOSITIONS AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-09-12 — — US disclosed
US-20130236833-A1 COATING COMPOSITIONS AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-09-12 — — US disclosed
US-8455176-B2 Coating composition AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-06-04 — — US disclosed
US-8455176-B2 Coating composition AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-06-04 — — US disclosed
WO-2010055406-A2 COATING COMPOSITIONS AZ ELECTRONIC MATERIALS USA CORP. (US) 2010-05-20 — — WO disclosed
US-20100119972-A1 COATING COMPOSITION MERCK PATENT GMBH (DE) 2010-05-13 — — US disclosed
US-20100119972-A1 COATING COMPOSITION MERCK PATENT GMBH (DE) 2010-05-13 — — 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-20100119972-A1 COATING COMPOSITION S100A9, CAPG, C5 KDM4E 1075/4885HPGD 4813/4885POLB 1486/4885

“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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