SCHEMBL13232107

SCHEMBL13232107

CC(CC(=O)Nc1ccccc1C(=O)c1ccccc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
KMT2A Q03164 3/20 0.49
PSMB5 P28074 1/20 0.48
KDM4E B2RXH2 2/20 0.48
HSD17B10 Q99714 1/20 0.48
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
RECQL P46063 1/20 0.47
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PPARG P37231 2/20 0.44
MAPK1 P28482 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL13232104 0.83 KMT2A (0.68) ALDH1A1KMT2AKDM4EHSD17B10HPGD
SCHEMBL7032067 0.80 ALDH1A1 (0.71) ALDH1A1KMT2APSMB5KDM4EHPGD
SCHEMBL27388643 0.79 KMT2A (0.51) ALDH1A1KMT2AKDM4EPPARG
SCHEMBL14397981 0.79 ALDH1A1 (0.73) ALDH1A1KMT2APSMB5HPGDHTT
SCHEMBL11883414 0.79 ALDH1A1 (0.73) ALDH1A1KMT2APSMB5HPGDHTT
SCHEMBL10814639 0.77 ALDH1A1 (1.00) ALDH1A1KMT2APSMB5HPGDHTT
SCHEMBL31541283 0.77 ALDH1A1 (1.00) ALDH1A1KMT2APSMB5HPGDHTT
SCHEMBL8672570 0.77 ALDH1A1 (0.71) ALDH1A1KMT2APSMB5HPGDHTT
SCHEMBL11458326 0.77 ALDH1A1 (0.71) ALDH1A1KMT2APSMB5KDM4EHPGD
SCHEMBL29485041 0.77 ALDH1A1 (0.71) ALDH1A1KMT2APSMB5HPGDHTT

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9657228-B2 Performance boosting UV-absorbing compounds ISP INVESTMENTS LLC (US) 2017-05-23 US disclosed
US-9657228-B2 Performance boosting UV-absorbing compounds ISP INVESTMENTS LLC (US) 2017-05-23 US disclosed
US-20140023601-A1 PERFORMANCE BOOSTING UV-ABSORBING COMPOUNDS ISP INVESTMENT INC. (US) 2014-01-23 US disclosed
US-20140023601-A1 PERFORMANCE BOOSTING UV-ABSORBING COMPOUNDS ISP INVESTMENT INC. (US) 2014-01-23 US disclosed
US-8557226-B2 Performance-boosting UV-absorbing compounds ISP INVESTMENTS INC. (US) 2013-10-15 US disclosed
US-8557226-B2 Performance-boosting UV-absorbing compounds ISP INVESTMENTS INC. (US) 2013-10-15 US disclosed
US-20100183532-A1 Performance-Boosting UV-Absorbing Compounds HERCULES LLC 2010-07-22 US disclosed
US-20100183532-A1 Performance-Boosting UV-Absorbing Compounds HERCULES LLC 2010-07-22 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-20100183532-A1 Performance-Boosting UV-Absorbing Compounds APOB, ALOX5, RARG ALDH1A1 118/4885KMT2A 4151/4885PSMB5 821/4885

“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.