SCHEMBL21560123

SCHEMBL21560123

O=C(Cc1csc(-c2ccccc2)n1)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ P2RY14 Q15391 1/20 0.55
▸ ALOX15 P16050 1/20 0.54
▸ ACE P12821 3/20 0.54
▸ ITGB2 P05107 1/20 0.53
▸ ICAM1 P05362 1/20 0.53
▸ ITGAL P20701 1/20 0.53
▸ POLB P06746 2/20 0.53
▸ SHMT1 P34896 1/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ ECE1 P42892 1/20 0.53
▸ ERAP2 Q6P179 1/20 0.52
▸ LTA4H P09960 1/20 0.52
▸ TP53 P04637 1/20 0.52

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
SCHEMBL20255990 1.00 P2RY14 (0.55) P2RY14ALOX15ACEITGB2ICAM1
SCHEMBL20255508 0.95 SHMT1 (0.57) P2RY14ALOX15ACEITGB2ICAM1
SCHEMBL21560256 0.95 SHMT1 (0.56) P2RY14ALOX15ACEITGB2ICAM1
SCHEMBL20255789 0.95 P2RY14 (0.61) P2RY14ALOX15ACEITGB2ICAM1
SCHEMBL20255511 0.95 SHMT1 (0.56) P2RY14ALOX15ACEITGB2ICAM1
SCHEMBL20255602 0.93 KMT2A (0.61) P2RY14ACEITGB2ICAM1ITGAL
SCHEMBL20255603 0.93 POLB (0.63) P2RY14ALOX15ACEPOLBSHMT1
SCHEMBL21560303 0.93 ITGB2 (0.55) P2RY14ACEITGB2ICAM1ITGAL
SCHEMBL21560329 0.93 ITGB2 (0.55) P2RY14ACEITGB2ICAM1ITGAL
SCHEMBL21560221 0.93 ITGB2 (0.55) P2RY14ALOX15ACEITGB2ICAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11091451-B2 SHMT inhibitors and uses thereof RAZE THERAPEUTICS, INC. (US) 2021-08-17 — — US disclosed
US-20190345119-A1 SHMT INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. 2019-11-14 — — 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 (2 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-11091451-B2 SHMT inhibitors and uses thereof SHMT1, SHMT2, BHMT P2RY14 4686/4885ALOX15 1598/4885ACE 2172/4885
US-20190345119-A1 SHMT INHIBITORS AND USES THEREOF SHMT1, SHMT2, BHMT P2RY14 4686/4885ALOX15 1598/4885ACE 2172/4885

“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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