SCHEMBL3486614

SCHEMBL3486614

O=c1nc(-c2ccccc2)c2cccc(Cl)c2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.59
▸ HSD17B10 Q99714 2/20 0.59
▸ ALDH1A1 P00352 2/20 0.59
▸ HPGD P15428 2/20 0.59
▸ TSHR P16473 1/20 0.59
▸ NPSR1 Q6W5P4 3/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ CASP1 P29466 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ MAP2 P11137 1/20 0.47
▸ PDE3B Q13370 1/20 0.46
▸ PDE3A Q14432 1/20 0.46
▸ DYRK1A Q13627 3/20 0.46
▸ CLK1 P49759 1/20 0.45
▸ CDK9 P50750 1/20 0.45
▸ CDK5 Q00535 1/20 0.45
▸ DYRK2 Q92630 1/20 0.45
▸ CLK4 Q9HAZ1 1/20 0.45
▸ DYRK1B Q9Y463 1/20 0.45
▸ GUSB P08236 2/20 0.43

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
SCHEMBL11607166 0.82 KDM4E (0.63) KDM4EHSD17B10ALDH1A1HPGDTSHR
SCHEMBL17367229 0.79 KDM4E (0.61) KDM4EHSD17B10ALDH1A1HPGDTSHR
SCHEMBL13321779 0.76 TDO2 (0.58) KDM4EHSD17B10ALDH1A1HPGDTSHR
SCHEMBL29760362 0.76 PARP1 (0.49) KDM4EHPGDMEN1KMT2ADYRK1A
SCHEMBL14843788 0.76 PARP1 (0.49) KDM4EHPGDMEN1KMT2ADYRK1A
SCHEMBL20247021 0.75 KDM4E (0.59) KDM4EHSD17B10ALDH1A1HPGDTSHR
SCHEMBL4142958 0.75 KDM4E (1.00) KDM4EHSD17B10ALDH1A1HPGDTSHR
Lithium SCHEMBL30669498 0.73 KDM4E (0.96) KDM4EHSD17B10ALDH1A1HPGDTSHR
SCHEMBL14347584 0.73 DAO (0.46) KDM4EMEN1KMT2ADYRK1ACLK1
SCHEMBL14374778 0.73 RXFP1 (0.43) KDM4EHPGDMEN1KMT2ADYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2100507-B1 QUINAZOLINE DERIVATIVES CAPABLE OF INHIBITING CYTOKININ SIGNALING SUMITOMO CHEMICAL CO (JP) 2015-02-25 — — EP disclosed
US-8722580-B2 Agent for inhibiting cytokinin signaling SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-05-13 — — US disclosed
US-20100056377-A1 AGENT FOR INHIBITING CYTOKININ SIGNALING SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-04 — — US disclosed
CN-101588716-A Substance capable of inhibiting cytokinin signaling SUMITOMO CHEMICAL CO (JP) 2009-11-25 — — CN disclosed
EP-2100507-A1 SUBSTANCE CAPABLE OF INHIBITING CYTOKININ SIGNALING Sumitomo Chemical Company, Limited (JP) 2009-09-16 — — 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-20100056377-A1 AGENT FOR INHIBITING CYTOKININ SIGNALING CROCC, STAT3, GRK6 KDM4E 4572/4885HSD17B10 4139/4885ALDH1A1 2316/4885

“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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