SCHEMBL14415013

SCHEMBL14415013

C/N=c1/ccc2c(-c3c(Cl)cc(C(=O)NCCNC(=O)c4ccc(-c5c6ccc(=O)cc-6oc6cc(O)ccc56)c(C(=O)O)c4)c(Cl)c3C(=O)O)c3ccc(N(C)C)cc3oc-2c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.45
▸ SLC5A2 P31639 4/20 0.45
▸ USP2 O75604 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ P2RY6 Q15077 1/20 0.43
▸ HAVCR2 Q8TDQ0 1/20 0.43
▸ AVPR2 P30518 1/20 0.42
▸ OXTR P30559 1/20 0.42
▸ AVPR1A P37288 1/20 0.42
▸ ALB P02768 1/20 0.42
▸ HTR3A P46098 1/20 0.41
▸ ESR1 P03372 1/20 0.41

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
SCHEMBL14115540 0.94 FOLH1 (0.46) FOLH1SLC5A2USP2L3MBTL1CA9
SCHEMBL14415021 0.92 CA9 (0.47) SLC5A2USP2L3MBTL1CA9ALB
SCHEMBL13024588 0.91 P2RY6 (0.54) FOLH1SLC5A2USP2L3MBTL1CA9
SCHEMBL10293949 0.91 FOLH1 (0.46) FOLH1SLC5A2USP2L3MBTL1CA9
SCHEMBL14415018 0.88 ESR1 (0.47) SLC5A2USP2L3MBTL1CA9ALB
SCHEMBL14115544 0.86 CA9 (0.46) FOLH1SLC5A2USP2L3MBTL1CA9
SCHEMBL14415030 0.86 ESR1 (0.47) SLC5A2USP2L3MBTL1CA9HAVCR2
SCHEMBL14597203 0.85 SLC5A2 (0.45) FOLH1SLC5A2USP2L3MBTL1CA9
SCHEMBL14414996 0.85 SLC5A2 (0.41) FOLH1SLC5A2CA9P2RY6HAVCR2
SCHEMBL14415009 0.84 ESR1 (0.54) FOLH1SLC5A2USP2L3MBTL1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070212709-A1 Non-nucleosidic linker linking xanthene donor to 4,7-dichlororhodamine acceptor; APPLERA CORPORATION (US) 2007-09-13 — — 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-20070212709-A1 Non-nucleosidic linker linking xanthene donor to 4,7-dichlororhodamine acceptor; DCLRE1A, SLC25A21, DIMT1 FOLH1 3447/4885SLC5A2 3732/4885USP2 4472/4885

“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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