SCHEMBL15910903

SCHEMBL15910903

Nc1cccc2c1ccn2C1COC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.47
▸ SYK P43405 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.34
▸ HPGD P15428 3/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ DDB1 Q16531 1/20 0.32
▸ CRBN Q96SW2 1/20 0.32
▸ DGAT1 O75907 1/20 0.32
▸ KDR P35968 1/20 0.31
▸ AURKB Q96GD4 1/20 0.31
▸ KEAP1 Q14145 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL15910759 0.88 LOXL2 (0.39) LOXL2SYKDDB1CRBNKDR
SCHEMBL15910760 0.88 LOXL2 (0.39) LOXL2SYKDDB1CRBNKDR
SCHEMBL15910593 0.84 ALDH1A1 (0.38) LOXL2SYKALDH1A1HPGDCYP3A4
SCHEMBL15910562 0.81 MEN1 (0.38) LOXL2SYKALDH1A1HPGDCYP3A4
SCHEMBL17818945 0.80 LOXL2 (0.47) LOXL2
SCHEMBL18361828 0.80 LOXL2 (0.44) LOXL2SYKHPGDTSHRHSD17B10
SCHEMBL20348543 0.80 LOXL2 (0.44) LOXL2SYKALDH1A1KDM4E
SCHEMBL30098886 0.78 OPRL1 (0.40) ALDH1A1HPGDKDM4E
SCHEMBL17422116 0.78 HTR6 (0.43) ALDH1A1HPGDCYP3A4TSHRHSD17B10
SCHEMBL34469789 0.76 LOXL2 (0.37) LOXL2SYKDGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9145414-B2 1,2,4-triazine-6-carboxamide derivative TAIHO PHARMACEUTICAL CO., LTD. (JP) 2015-09-29 — — US disclosed
US-20140343038-A1 1,2,4-TRIAZINE-6-CARBOXAMIDE DERIVATIVE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2014-11-20 — — US disclosed
EP-2762476-A1 1,2,4-TRIAZINE-6-CARBOXAMIDE DERIVATIVE Taiho Pharmaceutical Co., Ltd. (JP) 2014-08-06 — — EP 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-20140343038-A1 1,2,4-TRIAZINE-6-CARBOXAMIDE DERIVATIVE SYK, BTK, JAK2 LOXL2 2790/4885SYK 1/4885ALDH1A1 3232/4885

“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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