SCHEMBL4236701

SCHEMBL4236701

O=C(O)c1ccc(COC2(N3C(=O)c4ccccc4C3=O)CCCCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.46
RXRA P19793 4/20 0.43
RXRB P28702 3/20 0.43
RXRG P48443 2/20 0.43
ALDH1A1 P00352 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
SCN2A Q99250 1/20 0.43
KMT2A Q03164 4/20 0.40
HPGD P15428 3/20 0.40
KDM4E B2RXH2 1/20 0.40
PSMD14 O00487 1/20 0.40
MAPT P10636 1/20 0.40
CRHBP P24387 1/20 0.40
PPARG P37231 1/20 0.40
CRHR2 Q13324 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
NR4A1 P22736 1/20 0.40

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
SCHEMBL6531059 0.80 ALDH1A1 (0.54) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL6658175 0.72 GSK3A (0.40) ALDH1A1KMT2AMEN1
SCHEMBL5009464 0.71 ALDH1A1 (0.40) ALDH1A1KMT2AHPGDKDM4EMAPT
SCHEMBL4238428 0.70 RXRA (0.43) RXRARXRBRXRGALDH1A1NR4A1
SCHEMBL4236475 0.68 HRH3 (0.39) RXRARXRBRXRGALDH1A1KMT2A
SCHEMBL11097129 0.67 KMT2A (0.40) ALDH1A1CA12CA9KMT2APOLB
SCHEMBL11611884 0.67 ALDH1A1 (0.67) ALDH1A1CA12CA1CA2CA9
SCHEMBL31753078 0.67 KMT2A (0.74) PPARACA12CA1CA2CA9
SCHEMBL29885176 0.67 ALDH1A1 (0.67) ALDH1A1CA12CA1CA2CA9
SCHEMBL916927 0.67 KMT2A (0.74) PPARACA12CA1CA2CA9

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R PPARA 538/4885RXRA 735/4885RXRB 626/4885

“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.