SCHEMBL14349708

SCHEMBL14349708

COc1ccc2cc(CCCCC(=O)Nc3ccccc3C(=O)O)ccc2c1

nearest known ligand 0.85

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HCAR2 Q8TDS4 11/20 0.85
▸ POLB P06746 1/20 0.56
▸ RAB9A P51151 2/20 0.55
▸ MEN1 O00255 1/20 0.54
▸ CASP3 P42574 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ SENP8 Q96LD8 1/20 0.54
▸ SENP7 Q9BQF6 1/20 0.54
▸ SENP6 Q9GZR1 1/20 0.54
▸ PLK1 P53350 1/20 0.49
▸ PLK3 Q9H4B4 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ HDAC1 Q13547 1/20 0.49
▸ HDAC6 Q9UBN7 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ NPC1 O15118 1/20 0.49

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
SCHEMBL14349717 0.92 HCAR2 (1.00) HCAR2RAB9AMEN1CASP3KMT2A
SCHEMBL14349695 0.89 HCAR2 (1.00) HCAR2RAB9AMEN1CASP3KMT2A
SCHEMBL14349711 0.86 HCAR2 (0.86) HCAR2HDAC1
SCHEMBL14349694 0.85 HCAR2 (0.93) HCAR2RAB9AMEN1CASP3KMT2A
SCHEMBL14349704 0.82 HCAR2 (0.74) HCAR2RAB9AMEN1CASP3KMT2A
SCHEMBL13781556 0.82 HCAR2 (0.58) HCAR2POLBRAB9ASMN1; SMN2HDAC1
SCHEMBL27549736 0.81 HCAR2 (0.80) HCAR2RAB9ASMN1; SMN2ALDH1A1HDAC1
SCHEMBL14349702 0.81 HCAR2 (0.66) HCAR2POLBRAB9AMEN1CASP3
SCHEMBL27546641 0.81 HCAR2 (0.79) HCAR2POLBRAB9ASMN1; SMN2KDM4E
SCHEMBL5623042 0.80 HCAR2 (0.85) HCAR2MEN1CASP3KMT2ASENP8

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-20070299101-A1 Niacin Receptor Agonists, Compositions Containing Such Compounds and Methods of Treatment MERCK SHARP & DOHME CORP. 2007-12-27 — — US disclosed
US-20070299101-A1 Niacin Receptor Agonists, Compositions Containing Such Compounds and Methods of Treatment MERCK SHARP & DOHME CORP. 2007-12-27 — — 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-20070299101-A1 Niacin Receptor Agonists, Compositions Containing Such Compounds and Methods of Treatment LDLR, APOB, FFAR1 HCAR2 20/4885POLB 4030/4885RAB9A 2981/4885

“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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