SCHEMBL29501124

SCHEMBL29501124

O=C(O)N1CCOc2ccccc2C1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 6/20 0.54
AHR P35869 2/20 0.50
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
PIK3CA P42336 3/20 0.45
GPR142 Q7Z601 2/20 0.45
NOTUM Q6P988 2/20 0.44
APP P05067 1/20 0.43
THRB P10828 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.41

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
SCHEMBL17957763 1.00 RIPK1 (0.54) RIPK1AHRALDH1A1KDM4EPIK3CA
SCHEMBL7949587 0.85 NOTUM (0.58) RIPK1AHRALDH1A1KDM4EPIK3CA
SCHEMBL31171764 0.83 NOTUM (0.44) RIPK1AHRALDH1A1NOTUMTHRB
SCHEMBL29471404 0.81 CREBBP (0.57)
SCHEMBL21505115 0.81 ALDH1A1 (0.50) RIPK1AHRALDH1A1KDM4EPIK3CA
SCHEMBL18794297 0.81 KDM4E (0.53) RIPK1AHRALDH1A1KDM4ENOTUM
SCHEMBL15055636 0.78 RIPK1 (0.46) RIPK1PIK3CAGPR142KMT2A
SCHEMBL3789225 0.78 RIPK1 (0.46) RIPK1PIK3CAGPR142
SCHEMBL31046947 0.78 MAPK1 (0.57) RIPK1AHRALDH1A1KDM4E
SCHEMBL11985662 0.78 MAPK1 (0.57) RIPK1AHRALDH1A1KDM4E

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-11279681-B2 3-alkyl bicyclic [4,5,0] hydroxamic acids as HDAC inhibitors VALO HEALTH, INC. (US) 2022-03-22 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-11279681-B2 3-alkyl bicyclic [4,5,0] hydroxamic acids as HDAC inhibitors HDAC1, HDAC4, HDAC2 RIPK1 3664/4885AHR 1222/4885ALDH1A1 1465/4885

“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.