SCHEMBL17345610

SCHEMBL17345610

Cc1cccc2cccc(C(=O)CCC(=O)O)c12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.58
▸ HSD17B10 Q99714 4/20 0.58
▸ ALDH1A1 P00352 4/20 0.58
▸ KDM4E B2RXH2 3/20 0.58
▸ HPGD P15428 3/20 0.58
▸ CYP1A2 P05177 2/20 0.58
▸ POLB P06746 2/20 0.58
▸ CYP2D6 P10635 2/20 0.58
▸ GLA P06280 1/20 0.58
▸ MEN1 O00255 3/20 0.50
▸ CTNNB1 P35222 4/20 0.45
▸ WNT3A P56704 4/20 0.45
▸ HTT P42858 1/20 0.45
▸ NR4A2 P43354 1/20 0.43
▸ ERCC5 P28715 1/20 0.40
▸ FEN1 P39748 1/20 0.40
▸ GMNN O75496 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ CYP3A4 P08684 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
SCHEMBL17341965 0.92 KMT2A (0.49) KMT2AHSD17B10ALDH1A1KDM4EHPGD
SCHEMBL17341981 0.90 KMT2A (0.48) KMT2AHSD17B10ALDH1A1KDM4EHPGD
SCHEMBL17341961 0.87 CTNNB1 (0.45) KMT2AHSD17B10ALDH1A1KDM4EHPGD
SCHEMBL17345607 0.83 KMT2A (0.48) KMT2AHSD17B10ALDH1A1KDM4EHPGD
SCHEMBL19821107 0.82 CTNNB1 (0.41) KMT2AHSD17B10ALDH1A1KDM4EHPGD
SCHEMBL7475817 0.81 KMT2A (0.54) KMT2AHSD17B10ALDH1A1KDM4EHPGD
SCHEMBL17341972 0.81 CTNNB1 (0.40) KMT2AHSD17B10ALDH1A1KDM4EHPGD
SCHEMBL29541385 0.80 KMT2A (0.62) KMT2AALDH1A1CYP1A2MEN1CTNNB1
SCHEMBL828846 0.80 KMT2A (0.62) KMT2AALDH1A1CYP1A2MEN1CTNNB1
SCHEMBL3388726 0.78 HSD17B10 (0.64) KMT2AHSD17B10ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10377716-B2 Composition and method for prevention, mitigation or treatment of an enteropathogenic bacterial infection TRUSTEES OF DARTMOUTH COLLEGE (US) 2019-08-13 — — US disclosed
US-20180029990-A1 COMPOSITION AND METHOD FOR PREVENTION, MITIGATION OR TREATMENT OF AN ENTEROPATHOGENIC BACTERIAL INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-02-01 — — US disclosed
US-9790186-B2 Composition and method for prevention, mitigation or treatment of an enteropathogenic bacterial infection TRUSTEES OF DARTMOUTH COLLEGE (US) 2017-10-17 — — US disclosed
US-20150361045-A1 COMPOSITION AND METHOD FOR PREVENTION, MITIGATION OR TREATMENT OF AN ENTEROPATHOGENIC BACTERIAL INFECTION TRUSTEES OF DARTMOUTH COLLEGE (US) 2015-12-17 — — 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 (3 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-10377716-B2 Composition and method for prevention, mitigation or treatment of an enteropathogenic bacterial infection FABP2, LRBA, VIP KMT2A 4736/4885HSD17B10 1369/4885ALDH1A1 4615/4885
US-20150361045-A1 COMPOSITION AND METHOD FOR PREVENTION, MITIGATION OR TREATMENT OF AN ENTEROPATHOGENIC BACTERIAL INFECTION FABP2, LRBA, VIP KMT2A 4736/4885HSD17B10 1369/4885ALDH1A1 4615/4885
US-20180029990-A1 COMPOSITION AND METHOD FOR PREVENTION, MITIGATION OR TREATMENT OF AN ENTEROPATHOGENIC BACTERIAL INFECTION FABP2, LRBA, VIP KMT2A 4736/4885HSD17B10 1369/4885ALDH1A1 4615/4885

“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.

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