SCHEMBL2118437

SCHEMBL2118437

COCc1ccnc(NC(=O)OC(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 1/20 0.46
▸ CCR2 P41597 2/20 0.46
▸ CYP17A1 P05093 1/20 0.45
▸ ATR Q13535 1/20 0.45
▸ NR3C2 P08235 8/20 0.44
▸ DYRK1A Q13627 2/20 0.43
▸ CDK5 Q00535 1/20 0.43
▸ CDK5R1 Q15078 1/20 0.43
▸ TYK2 P29597 1/20 0.41
▸ GSK3B P49841 1/20 0.41
▸ AAK1 Q2M2I8 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SCN9A Q15858 1/20 0.39
▸ P2RX3 P56373 1/20 0.39

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
SCHEMBL1940483 0.86 IGF1R (0.48) IGF1RCCR2CYP17A1ATRNR3C2
SCHEMBL15354529 0.86 RIOK2 (0.50) IGF1RCCR2CYP17A1ATRNR3C2
SCHEMBL29575346 0.86 IGF1R (0.48) IGF1RCCR2CYP17A1ATRNR3C2
SCHEMBL30468562 0.85 IGF1R (0.46) IGF1RCCR2CYP17A1ATRNR3C2
SCHEMBL20536182 0.85 IGF1R (0.46) IGF1RCCR2CYP17A1ATRNR3C2
SCHEMBL12953977 0.85 IGF1R (0.47) IGF1RCCR2CYP17A1ATRNR3C2
SCHEMBL167992 0.85 IGF1R (0.47) IGF1RCCR2CYP17A1ATRNR3C2
SCHEMBL10087555 0.85 NR3C2 (0.49) IGF1RCCR2CYP17A1ATRNR3C2
SCHEMBL626850 0.85 LOXL2 (0.51) IGF1RCCR2CYP17A1ATRNR3C2
SCHEMBL3921965 0.85 IGF1R (0.44) IGF1RCCR2CYP17A1ATRNR3C2

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-2626350-B1 CYCLOPROPANE COMPOUND EISAI R&D MAN CO LTD (JP) 2015-04-15 — — EP disclosed
EP-2626350-B1 CYCLOPROPANE COMPOUND EISAI R&D MAN CO LTD (JP) 2015-04-15 — — EP disclosed
EP-2626350-A1 CYCLOPROPANE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2013-08-14 — — EP disclosed
US-8268848-B2 Cyclopropane compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-09-18 — — US disclosed
US-20120095031-A1 CYCLOPROPANE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-19 — — 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-20120095031-A1 CYCLOPROPANE COMPOUND HCRTR1, HCRTR2, CNR1 IGF1R 497/4885CCR2 267/4885CYP17A1 651/4885

“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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