SCHEMBL30946117

SCHEMBL30946117

O=C(NCc1cc2cc(Cl)c(OCc3cscn3)cc2[nH]1)N1CCCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ MET P08581 1/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ EGFR P00533 2/20 0.34
▸ ERBB2 P04626 1/20 0.34
▸ CYP2C9 P11712 2/20 0.33
▸ EPHX2 P34913 2/20 0.33
▸ CYP2J2 P51589 2/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ NMT1 P30419 1/20 0.33
▸ SCN9A Q15858 4/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ MGLL Q99685 1/20 0.33
▸ GRIN2B Q13224 1/20 0.33
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL27247117 1.00 GRM5 (0.37) GRM5SMN1; SMN2HTTHPGDTP53
SCHEMBL27247071 0.98 GRM5 (0.37) GRM5SMN1; SMN2HTTHPGDTP53
SCHEMBL30920146 0.98 GRM5 (0.37) GRM5SMN1; SMN2HTTHPGDTP53
SCHEMBL27247555 0.90 GRM5 (0.35) GRM5SMN1; SMN2MAPK1EGFRERBB2
SCHEMBL30920320 0.90 GRM5 (0.35) GRM5SMN1; SMN2MAPK1EGFRERBB2
SCHEMBL30946236 0.89 MAPK1 (0.36) GRM5SMN1; SMN2RAB9AMETMAPK1
SCHEMBL27247420 0.89 MET (0.35) GRM5RAB9AMETMAPK1KIT
SCHEMBL30946212 0.89 MET (0.35) GRM5RAB9AMETMAPK1KIT
SCHEMBL27246866 0.89 MAPK1 (0.36) GRM5SMN1; SMN2RAB9AMETMAPK1
SCHEMBL30946164 0.89 GRM5 (0.34) GRM5SMN1; SMN2MAPK1EGFRERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240199546-A1 INHIBITORS OF SOLUTE CARRIER FAMILY 6A MEMBER 19 (SLC6A19) AND METHODS OF USE THEREOF HERCULES CAPITAL, INC., AS AGENT 2024-06-20 — — 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 (1 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-20240199546-A1 INHIBITORS OF SOLUTE CARRIER FAMILY 6A MEMBER 19 (SLC6A19) AND METHODS OF USE THEREOF SLC6A19, SLC2A9, SLC6A3 GRM5 690/4885SMN1; SMN2 375/4885HTT 141/4885

“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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