SCHEMBL26308166

SCHEMBL26308166

CCCCC(CCC)C(=O)N1CCN(C)CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 2/20 0.42
NPC1 O15118 1/20 0.42
CA2 P00918 6/20 0.41
CA1 P00915 4/20 0.41
HTR1A P08908 1/20 0.41
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
CYP1A2 P05177 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP2C19 P33261 1/20 0.39
CHRM1 P11229 2/20 0.38

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
SCHEMBL21078258 0.93 HTR1A (0.46) ALDH1A1TSHRKDM4ENPC1HTR1A
SCHEMBL20444070 0.92 CA2 (0.47) ALDH1A1USP2LMNATSHRKDM4E
SCHEMBL18782931 0.90 CA2 (0.44) ALDH1A1USP2LMNATSHRKDM4E
SCHEMBL22628668 0.90 CA2 (0.44) ALDH1A1USP2LMNATSHRKDM4E
SCHEMBL18949009 0.90 CA2 (0.44) ALDH1A1USP2LMNATSHRKDM4E
SCHEMBL23691156 0.90 ALDH1A1 (0.56) ALDH1A1USP2LMNATSHRKDM4E
SCHEMBL21846071 0.86 L3MBTL1 (0.47) ALDH1A1USP2LMNATSHRCA2
SCHEMBL20416320 0.86 CYP2C19 (0.47) ALDH1A1USP2LMNATSHRKDM4E
SCHEMBL23241202 0.84 L3MBTL1 (0.49) ALDH1A1USP2LMNATSHRCA2
SCHEMBL23567362 0.83 ALDH1A1 (0.50) ALDH1A1USP2LMNATSHRKDM4E

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-12030876-B2 Aryl hydrocarbon receptor (AHR) agonists and uses thereof Ikena Oncology, Inc. (US) 2024-07-09 US disclosed
US-20230295147-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF ARYL THERAPEUTICS, INC. 2023-09-21 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 (2 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-12030876-B2 Aryl hydrocarbon receptor (AHR) agonists and uses thereof AHR, ARNT, HCAR1 ALDH1A1 289/4885USP2 1271/4885LMNA 3518/4885
US-20230295147-A1 ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS AND USES THEREOF AHR, ARNT, HCAR1 ALDH1A1 289/4885USP2 1271/4885LMNA 3518/4885

“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.