SCHEMBL3786371

SCHEMBL3786371

C[C@@H](OC(=O)O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.61
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TP53 P04637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
FFAR1 O14842 1/20 0.45
CYP2D6 P10635 1/20 0.44
SRC P12931 1/20 0.44
CYP3A4 P08684 1/20 0.44
LPAR1 Q92633 2/20 0.43
LPAR3 Q9UBY5 1/20 0.43
LMNA P02545 2/20 0.43
MAPK1 P28482 1/20 0.43
ALOX5 P09917 2/20 0.42
TSHR P16473 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42

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
SCHEMBL871943 1.00 HCAR2 (0.61) HCAR2KMT2AALDH1A1TP53HSD17B10
SCHEMBL3625234 1.00 HCAR2 (0.61) HCAR2KMT2AALDH1A1TP53HSD17B10
SCHEMBL3625229 0.86 HCAR2 (0.61) HCAR2KMT2AALDH1A1TP53HSD17B10
SCHEMBL1694877 0.86 HCAR2 (0.61) HCAR2KMT2AALDH1A1TP53HSD17B10
SCHEMBL3786370 0.86 HCAR2 (0.61) HCAR2KMT2AALDH1A1TP53HSD17B10
SCHEMBL8088686 0.86 HCAR2 (0.61) HCAR2KMT2AALDH1A1TP53HSD17B10
SCHEMBL6267290 0.84 HCAR2 (0.59) HCAR2KMT2AALDH1A1TP53HSD17B10
SCHEMBL6392245 0.84 HCAR2 (0.59) HCAR2KMT2AALDH1A1TP53HSD17B10
SCHEMBL25961164 0.84 HCAR2 (0.59) HCAR2KMT2AALDH1A1TP53HSD17B10
SCHEMBL871942 0.84 HCAR2 (0.59) HCAR2KMT2AALDH1A1TP53HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324202-B2 5-phenyl-1H-benzo [E] [1,4] diazepine compounds substituted with an hydroxamic acid group as histone deacetylase inhibitors UNIVERSITA DEGLI STUDI DI FIRENZE (IT) 2012-12-04 US claimed
US-20240150359-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2024-05-09 US disclosed
EP-4320128-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2024-02-14 EP disclosed
US-11851438-B2 1′-cyano nucleoside analogs and methods for treatment of viral infections GILEAD SCIENCES, INC. (US) 2023-12-26 US disclosed
US-11845755-B2 Compounds and methods for treatment of viral infections GILEAD SCIENCES, INC. (US) 2023-12-19 US disclosed
US-11780844-B2 Compounds and methods for treatment of viral infections GILEAD SCIENCES, INC. (US) 2023-10-10 US disclosed
US-20230295172-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2023-09-21 US disclosed
US-20230279015-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2023-09-07 US disclosed
US-20230279013-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2023-09-07 US disclosed
US-20230279014-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2023-09-07 US disclosed
WO-2023167944-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2023-09-07 WO disclosed
EP-2231623-B1 5-PHENYL-1H-BENZO[E][1, 4]DIAZEPINE COMPOUNDS SUBSTITUTED WITH AN HYDROXAMIC ACID GROUP AS HISTONE DEACETYLASE INHIBITORS UNIV FIRENZE (IT) 2013-05-22 EP disclosed
US-8324202-B2 5-phenyl-1H-benzo [E] [1,4] diazepine compounds substituted with an hydroxamic acid group as histone deacetylase inhibitors UNIVERSITA DEGLI STUDI DI FIRENZE (IT) 2012-12-04 US disclosed
US-20100331316-A1 5-PHENYL-LH-BENZ0 [E] [1,4] DIAZEPINE COMPOUNDS SUBSTITUTED WITH AN HYDROXAMIC ACID GROUP AS HISTONE DEACETYLASE INHIBITORS A.I.L. FIRENZE SEZIONE AUTONOMA DI FIRENZE DELL'ASSOCIAZIONE ITALIANA CONTRO LE LEUCEMIE, LINFOMI E MIELOMA - ONLUS (IT) 2010-12-30 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 (9 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-11780844-B2 Compounds and methods for treatment of viral infections HAVCR2, EIF2AK2, OAT HCAR2 4109/4885KMT2A 3756/4885ALDH1A1 1784/4885
US-20240150359-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS HAVCR2, EIF2AK2, OAT HCAR2 4109/4885KMT2A 3756/4885ALDH1A1 1784/4885
US-20230279015-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS HAVCR2, EIF2AK2, OAT HCAR2 4109/4885KMT2A 3756/4885ALDH1A1 1784/4885
US-20230279014-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS HAVCR2, EIF2AK2, OAT HCAR2 4109/4885KMT2A 3756/4885ALDH1A1 1784/4885
US-20100331316-A1 5-PHENYL-LH-BENZ0 [E] [1,4] DIAZEPINE COMPOUNDS SUBSTITUTED WITH AN HYDROXAMIC ACID GROUP AS HISTONE DEACETYLASE INHIBITORS HDAC10, HDAC1, HDAC5 HCAR2 931/4885KMT2A 71/4885ALDH1A1 415/4885
US-11851438-B2 1′-cyano nucleoside analogs and methods for treatment of viral infections TYMP, PNP, SAMHD1 HCAR2 3853/4885KMT2A 4081/4885ALDH1A1 770/4885
US-20230279013-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS HAVCR2, EIF2AK2, OAT HCAR2 4109/4885KMT2A 3756/4885ALDH1A1 1784/4885
US-11845755-B2 Compounds and methods for treatment of viral infections HAVCR2, EIF2AK2, OAT HCAR2 4109/4885KMT2A 3756/4885ALDH1A1 1784/4885
US-20230295172-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS HAVCR2, EIF2AK2, OAT HCAR2 4109/4885KMT2A 3756/4885ALDH1A1 1784/4885

“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.