SCHEMBL14078003

SCHEMBL14078003

CC/N=c1/cc2oc3cc(NCC)c(C)cc3c(-c3ccccc3C(=O)ON3C(=O)CCC3=O)c-2cc1C

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.34
▸ USP2 O75604 2/20 0.33
▸ CFTR P13569 1/20 0.33
▸ PAX8 Q06710 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ GOPC Q9HD26 1/20 0.33
▸ HPGD P15428 3/20 0.32
▸ KDM4E B2RXH2 3/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ GAA P10253 2/20 0.32
▸ FTO Q9C0B1 2/20 0.32
▸ CASP1 P29466 2/20 0.32
▸ CASP7 P55210 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ BLM P54132 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ POLB P06746 2/20 0.32
▸ GLA P06280 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL12763964 0.91 ABCB1 (0.35) ABCB1USP2CFTRPAX8ATM
SCHEMBL14543547 0.88 KDM4E (0.31) HPGDKDM4EALDH1A1GAAFTO
SCHEMBL30056257 0.88 KDM4E (0.31) HPGDKDM4EALDH1A1GAAFTO
SCHEMBL13311374 0.88 ABCB1 (0.44) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL10028465 0.87 ABCB1 (0.38) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL4817749 0.87 ABCB1 (0.38) ABCB1USP2CFTRPAX8ATM
Hydrochloric Acid SCHEMBL29460430 0.87 USP2 (0.44) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL1495836 0.87 ABCB1 (0.38) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL23064834 0.86 USP2 (0.38) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL58076 0.86 USP2 (0.38) ABCB1USP2CFTRPAX8ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214811-A1 XANTHENE DYES BIOSEARCH TECHNOLOGIES, INC. (US) 2008-09-04 — — US disclosed
US-7344701-B2 Xanthene dyes BIOSEARCH TECHNOLOGIES, INC. (US) 2008-03-18 — — 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-20080214811-A1 XANTHENE DYES ANXA5, ANTXR2, XPOT ABCB1 56/4885USP2 3296/4885CFTR 3533/4885

“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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