SCHEMBL14368967

SCHEMBL14368967

COc1ccc(C(=O)N[C@@H]2CCCC[C@H]2CN2CCC(C)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.52
▸ POLB P06746 2/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ SSTR3 P32745 2/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ F10 P00742 1/20 0.48
▸ CCR3 P51677 5/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45

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
SCHEMBL14392348 0.91 SSTR3 (0.53) KMT2APOLBALDH1A1SSTR3F10
SCHEMBL14368821 0.91 SSTR3 (0.53) KMT2APOLBALDH1A1SSTR3F10
SCHEMBL14368693 0.91 KMT2A (0.55) KMT2APOLBALDH1A1HPGDSSTR3
SCHEMBL14392349 0.91 KMT2A (0.55) KMT2APOLBALDH1A1HPGDSSTR3
SCHEMBL14392690 0.90 SSTR3 (0.50) KMT2APOLBALDH1A1SSTR3F10
SCHEMBL14368825 0.90 SSTR3 (0.50) KMT2APOLBALDH1A1SSTR3F10
SCHEMBL5662592 0.89 HRH3 (0.52) KMT2AALDH1A1HPGDHRH3
SCHEMBL27757464 0.89 HRH3 (0.52) KMT2AALDH1A1HPGDHRH3
SCHEMBL14368968 0.88 TSHR (0.52) KMT2AALDH1A1SSTR3SMN1; SMN2F10
SCHEMBL4552939 0.88 TSHR (0.52) KMT2AALDH1A1SSTR3SMN1; SMN2F10

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-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 — — US disclosed
US-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 — — 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-20070259888-A1 Novel Compounds OPRL1, OPRM1, SIGMAR1 KMT2A 3736/4885POLB 4668/4885ALDH1A1 1047/4885

“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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