SCHEMBL29673271

SCHEMBL29673271

Cc1cccc(-c2nc(-c3ccc4c(c3)nnn4C3CCCC3)no2)c1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.70
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
TP53 P04637 3/20 0.50
TSHR P16473 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CASP3 P42574 2/20 0.50
SENP7 Q9BQF6 2/20 0.50
KDM4E B2RXH2 2/20 0.50
HSD17B10 Q99714 2/20 0.50
SENP6 Q9GZR1 1/20 0.50
RXFP1 Q9HBX9 1/20 0.47
POLB P06746 1/20 0.46
HCAR3 P49019 2/20 0.46
ALDH1A1 P00352 3/20 0.45
LMNA P02545 2/20 0.44
HPGD P15428 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
SCHEMBL23523957 1.00 GRM5 (0.70) GRM5GAAMAPTRAB9ANPC1
SCHEMBL30355726 0.99 GRM5 (0.69) GRM5GAAMAPTRAB9ANPC1
SCHEMBL23524080 0.99 GRM5 (0.69) GRM5GAAMAPTRAB9ANPC1
SCHEMBL23524180 0.89 GRM5 (0.70) GRM5GAAMAPTRAB9ANPC1
SCHEMBL23524185 0.89 GRM5 (0.80) GRM5GAAMAPTRAB9ANPC1
SCHEMBL23524319 0.89 GRM5 (0.72) GRM5MAPTRAB9ANPC1TP53
SCHEMBL23524417 0.88 GRM5 (0.71) GRM5MAPTRAB9ANPC1TP53
SCHEMBL23524398 0.88 GRM5 (0.74) GRM5GAAMAPTRAB9ANPC1
SCHEMBL23523815 0.87 GRM5 (0.72) GRM5MAPTRAB9ANPC1TP53
SCHEMBL23524232 0.87 GRM5 (0.67) GRM5MAPTRAB9ANPC1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114585360-B Methods of using the same for treating epilepsy 特维娜有限公司 2025-04-29 CN disclosed
US-11912693-B2 Compounds for modulating S1P1 activity and methods of using the same TREVENA, INC. (US) 2024-02-27 US disclosed
US-20230234946-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME TREVENA, INC. 2023-07-27 US disclosed
US-20230114241-A1 METHODS OF TREATING EPILEPSY USING THE SAME TREVENA, INC. 2023-04-13 US disclosed
CN-114585360-A Methods of using the same for the treatment of epilepsy 特维娜有限公司 2022-06-03 CN 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-20230234946-A1 COMPOUNDS FOR MODULATING S1P1 ACTIVITY AND METHODS OF USING THE SAME S1PR1, S1PR2, S1PR3 GRM5 456/4885GAA 3859/4885MAPT 3799/4885
US-20230114241-A1 METHODS OF TREATING EPILEPSY USING THE SAME S1PR1, S1PR2, S1PR3 GRM5 71/4885GAA 2241/4885MAPT 1551/4885
US-11912693-B2 Compounds for modulating S1P1 activity and methods of using the same S1PR1, S1PR2, S1PR3 GRM5 456/4885GAA 3859/4885MAPT 3799/4885

“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.