SCHEMBL17035290

SCHEMBL17035290

CN(C)c1ccc2cc(C(=O)CCC(=O)C(C)(C)C)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 4/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KDM2B Q8NHM5 1/20 0.40
THRA P10827 1/20 0.39
MAPT P10636 2/20 0.39
PTPN1 P18031 1/20 0.36
HDAC1 Q13547 2/20 0.36
CTNNB1 P35222 2/20 0.36
WNT3A P56704 2/20 0.36
HDAC8 Q9BY41 1/20 0.36
POLB P06746 1/20 0.34
TERT O14746 1/20 0.34
APP P05067 1/20 0.34

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
SCHEMBL17037958 0.84 HPGD (0.67) HPGDSMN1; SMN2KDM4EALDH1A1RAB9A
SCHEMBL17038474 0.81 ALDH1A1 (0.68) HPGDSMN1; SMN2KDM4EALDH1A1RAB9A
SCHEMBL21953325 0.80 HPGD (0.47) HPGDSMN1; SMN2KDM4EALDH1A1RAB9A
SCHEMBL29382443 0.79 SMN1; SMN2 (0.47) HPGDSMN1; SMN2KDM4EALDH1A1RAB9A
SCHEMBL158933 0.79 SMN1; SMN2 (0.47) HPGDSMN1; SMN2KDM4EALDH1A1RAB9A
SCHEMBL24277990 0.77 HPGD (0.44) HPGDSMN1; SMN2KDM4EALDH1A1RAB9A
Propane SCHEMBL626692 0.77 SMN1; SMN2 (0.46) HPGDSMN1; SMN2KDM4EALDH1A1RAB9A
SCHEMBL702196 0.77 PTPN1 (0.62) HPGDSMN1; SMN2KDM4EALDH1A1RAB9A
SCHEMBL29403777 0.77 PTPN1 (0.62) HPGDSMN1; SMN2KDM4EALDH1A1RAB9A
SCHEMBL26735842 0.77 HPGD (0.44) HPGDSMN1; SMN2KDM4EALDH1A1RAB9A

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-10626139-B2 Cationic steroidal antimicrobial compounds BRIGHAM YOUNG UNIVERSITY (US) 2020-04-21 US disclosed
US-20150239928-A1 CATIONIC STEROIDAL ANTIMICROBIAL COMPOUNDS BRIGHAM YOUNG UNIVERSITY (US) 2015-08-27 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 (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-10626139-B2 Cationic steroidal antimicrobial compounds CCL11, SERPINA6, CXCL10 HPGD 792/4885SMN1; SMN2 3512/4885KDM4E 4521/4885
US-20150239928-A1 CATIONIC STEROIDAL ANTIMICROBIAL COMPOUNDS CCL11, SERPINA6, CXCL10 HPGD 792/4885SMN1; SMN2 3512/4885KDM4E 4521/4885

“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.