SCHEMBL13948890

SCHEMBL13948890

CNCc1cccc(Oc2ccc(Cl)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.55
▸ HTR2A P28223 9/20 0.53
▸ SLC6A4 P31645 9/20 0.53
▸ KCNH2 Q12809 8/20 0.53
▸ HTT P42858 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ KDM4E B2RXH2 2/20 0.52
▸ LMNA P02545 2/20 0.49
▸ PPARG P37231 1/20 0.49
▸ PPARA Q07869 1/20 0.49
▸ GAA P10253 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ FDFT1 P37268 1/20 0.44
▸ FFAR1 O14842 1/20 0.44

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
SCHEMBL1351804 0.86 KDM4E (0.62) ALDH1A1HTTSMN1; SMN2KDM4EMEN1
SCHEMBL13948896 0.85 ALDH1A1 (0.70) ALDH1A1HTTSMN1; SMN2KDM4EMEN1
SCHEMBL13948897 0.85 MMP13 (0.56) ALDH1A1HTR2ASLC6A4KCNH2HTT
SCHEMBL13973310 0.84 ALDH1A1 (0.57) ALDH1A1HTTSMN1; SMN2KDM4ELMNA
SCHEMBL13958879 0.83 ALDH1A1 (0.51) ALDH1A1HTTSMN1; SMN2KDM4ELMNA
SCHEMBL8241107 0.81 ALDH1A1 (0.62) ALDH1A1HTTSMN1; SMN2KDM4ELMNA
SCHEMBL17227470 0.81 KDM4E (0.50) ALDH1A1HTTSMN1; SMN2KDM4EMEN1
SCHEMBL8985544 0.81 MEN1 (0.64) ALDH1A1HTTSMN1; SMN2KDM4EGAA
SCHEMBL23229951 0.81 PRMT6 (0.59) ALDH1A1HTTSMN1; SMN2KDM4EMEN1
SCHEMBL13969804 0.80 KDM4E (0.48) ALDH1A1HTR2ASLC6A4KCNH2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720841-B1 QUINAZOLINE DERIVATIVES AND THERAPEUTIC USE THEREOF REXAHN PHARMACEUTICALS INC (US) 2015-11-04 — — EP disclosed
US-8404698-B2 Quinazoline derivatives and therapeutic use thereof REXAHN PHARMACEUTICALS, INC. (US) 2013-03-26 — — US disclosed
US-20090030021-A1 Quinazoline Derivatives and Therapeutic Use Thereof REXAHN PHARMACEUTICALS, INC. (US) 2009-01-29 — — US disclosed
US-7388014-B2 Quinazoline derivatives and therapeutic use thereof REXAHN PHARMACEUTICALS, INC. (US) 2008-06-17 — — 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-20090030021-A1 Quinazoline Derivatives and Therapeutic Use Thereof ABL1, NQO2, NRAS ALDH1A1 2085/4885HTR2A 3196/4885SLC6A4 1686/4885

“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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