SCHEMBL7904197

SCHEMBL7904197

Cc1cc(C(=O)O)c(NC(=O)c2ccc(C(C)(C)C)cc2)s1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2C Q14957 7/20 0.70
MAPT P10636 4/20 0.60
ALDH1A1 P00352 1/20 0.60
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
PTPN5 P54829 1/20 0.53
SERPINE1 P05121 1/20 0.53
KDM4E B2RXH2 2/20 0.51
ERO1A Q96HE7 1/20 0.51
MEN1 O00255 1/20 0.51
MITF O75030 1/20 0.51
KMT2A Q03164 1/20 0.51
KLF5 Q13887 1/20 0.51
NR1H4 Q96RI1 4/20 0.50
PPARG P37231 3/20 0.50
POLB P06746 1/20 0.50
TRPV1 Q8NER1 1/20 0.49
KCNK9 Q9NPC2 1/20 0.49
PPARA Q07869 1/20 0.48

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
SCHEMBL7894074 0.87 MAPT (0.57) GRIN2CMAPTALDH1A1NPC1RAB9A
SCHEMBL7894867 0.85 MAPT (0.71) GRIN2CMAPTALDH1A1NPC1RAB9A
SCHEMBL7904120 0.83 NPC1 (0.68) GRIN2CMAPTALDH1A1NPC1RAB9A
SCHEMBL7902807 0.83 NPSR1 (0.61) GRIN2CMAPTALDH1A1NPSR1KDM4E
SCHEMBL7906323 0.83 GRIN2C (1.00) GRIN2CMAPTALDH1A1NPC1RAB9A
SCHEMBL7894076 0.82 ALDH1A1 (0.58) MAPTALDH1A1NPC1RAB9ANPSR1
SCHEMBL5788877 0.77 MAPT (0.60) MAPTALDH1A1NPC1RAB9ANPSR1
SCHEMBL7894658 0.75 GRIN2C (1.00) GRIN2CMAPTALDH1A1KDM4EMEN1
SCHEMBL21411372 0.74 ALDH1A1 (0.49) MAPTALDH1A1NPC1RAB9ANPSR1
SCHEMBL14231868 0.74 NPSR1 (0.46) GRIN2CMAPTALDH1A1NPC1RAB9A

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-10273214-B2 Subunit selective NMDA receptor potentiators for the treatment of neurological conditions EMORY UNIVERSITY (US) 2019-04-30 US disclosed
US-20140275529-A1 SUBUNIT SELECTIVE NMDA RECEPTOR POTENTIATORS FOR THE TREATMENT OF NEUROLOGICAL CONDITIONS TRAYNELIS STEPHEN F (US) 2014-09-18 US disclosed
US-20140275529-A1 SUBUNIT SELECTIVE NMDA RECEPTOR POTENTIATORS FOR THE TREATMENT OF NEUROLOGICAL CONDITIONS TRAYNELIS STEPHEN F (US) 2014-09-18 US disclosed
US-8822462-B2 Subunit selective NMDA receptor potentiators for the treatment of neurological conditions EMORY UNIVERSITY (US) 2014-09-02 US disclosed
US-8822462-B2 Subunit selective NMDA receptor potentiators for the treatment of neurological conditions EMORY UNIVERSITY (US) 2014-09-02 US disclosed
US-20120028977-A1 Subunit Selective NMDA Receptor Potentiators For The Treatment Of Neurological Conditions EMORY UNIVERSITY (US) 2012-02-02 US disclosed
US-20120028977-A1 Subunit Selective NMDA Receptor Potentiators For The Treatment Of Neurological Conditions EMORY UNIVERSITY (US) 2012-02-02 US disclosed
WO-2010088414-A2 SUBUNIT SELECTIVE NMDA RECEPTOR POTENTIATORS FOR THE TREATMENT OF NEUROLOGICAL CONDITIONS EMORY UNIVERSITY (US) 2010-08-05 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 (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-10273214-B2 Subunit selective NMDA receptor potentiators for the treatment of neurological conditions GRIN1, GRIN2A, GRIN2B GRIN2C 5/4885MAPT 768/4885ALDH1A1 2048/4885
US-20120028977-A1 Subunit Selective NMDA Receptor Potentiators For The Treatment Of Neurological Conditions GRIN1, GRIN2A, GRIN2B GRIN2C 5/4885MAPT 768/4885ALDH1A1 2048/4885
US-20140275529-A1 SUBUNIT SELECTIVE NMDA RECEPTOR POTENTIATORS FOR THE TREATMENT OF NEUROLOGICAL CONDITIONS GRIN1, GRIN2A, GRIN2B GRIN2C 5/4885MAPT 768/4885ALDH1A1 2048/4885

“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.