SCHEMBL8749855

SCHEMBL8749855

Cc1ccccc1[C@@H](N)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 4/20 0.58
MEN1 O00255 2/20 0.58
CYP1A2 P05177 2/20 0.58
KMT2A Q03164 2/20 0.58
TDP1 Q9NUW8 1/20 0.58
ESR1 P03372 1/20 0.48
ACP3 P15309 1/20 0.46
ALDH1A1 P00352 1/20 0.44
CYP3A4 P08684 1/20 0.42
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL3611197 1.00 GRM1 (0.58) GRM1MEN1CYP1A2KMT2ATDP1
SCHEMBL29748155 1.00 GRM1 (0.58) GRM1MEN1CYP1A2KMT2ATDP1
SCHEMBL3611200 1.00 GRM1 (0.58) GRM1MEN1CYP1A2KMT2ATDP1
SCHEMBL29747857 1.00 GRM1 (0.58) GRM1MEN1CYP1A2KMT2ATDP1
Hydrochloric Acid SCHEMBL30405940 0.98 GRM1 (0.56) GRM1MEN1CYP1A2KMT2ATDP1
Hydrochloric Acid SCHEMBL3820573 0.98 GRM1 (0.56) GRM1MEN1CYP1A2KMT2ATDP1
Glycine SCHEMBL8009728 0.91 GRM1 (0.50) GRM1MEN1CYP1A2KMT2ATDP1
SCHEMBL24044801 0.84 MEN1 (0.48) GRM1MEN1CYP1A2KMT2ATDP1
SCHEMBL25660557 0.84 GRM1 (0.53) GRM1MEN1CYP1A2KMT2ATDP1
SCHEMBL1115084 0.83 ESR1 (0.48) GRM1MEN1CYP1A2KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250099481-A1 BCL-2 INHIBITORS NEWAVE PHARMACEUTICAL INC. 2025-03-27 US disclosed
WO-2023121713-A1 BCL-2 INHIBITORS NEW AVE PHARMACEUTICAL INC. (US) 2023-06-29 WO disclosed
US-20200123132-A1 ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC 2020-04-23 US disclosed
US-10344019-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2019-07-09 US disclosed
EP-3284741-A1 ANTIVIRAL COMPOUNDS Gilead Pharmasset LLC (US) 2018-02-21 EP disclosed
EP-2640719-B1 ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC (US) 2017-05-10 EP disclosed
US-20150353529-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2015-12-10 US disclosed
US-20150353529-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2015-12-10 US disclosed
US-9156823-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2015-10-13 US disclosed
US-9156823-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2015-10-13 US disclosed
US-20140018313-A1 ANTIVIRAL COMPOUNDS Gelead Sciences, Inc. 2014-01-16 US disclosed
US-20140018313-A1 ANTIVIRAL COMPOUNDS Gelead Sciences, Inc. 2014-01-16 US disclosed
WO-2012068234-A2 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2012-05-24 WO 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 (5 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-20140018313-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 GRM1 4079/4885MEN1 4292/4885CYP1A2 3826/4885
US-20250099481-A1 BCL-2 INHIBITORS BCL2, BCL2L1, BCL2L10 GRM1 4230/4885MEN1 432/4885CYP1A2 2579/4885
US-10344019-B2 Antiviral compounds MAVS, EIF2AK2, ZC3HAV1 GRM1 4079/4885MEN1 4292/4885CYP1A2 3826/4885
US-20150353529-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 GRM1 4079/4885MEN1 4292/4885CYP1A2 3826/4885
US-20200123132-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 GRM1 4079/4885MEN1 4292/4885CYP1A2 3826/4885

“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.