SCHEMBL29867952

SCHEMBL29867952

NCCCC[C@H](NC(=O)CN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 2/20 0.62
▸ ACE P12821 2/20 0.60
▸ ECE1 P42892 4/20 0.56
▸ ERAP2 Q6P179 1/20 0.56
▸ LTA4H P09960 1/20 0.56
▸ P2RY14 Q15391 1/20 0.56
▸ ALOX15 P16050 1/20 0.55

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
SCHEMBL31593374 0.97 GHSR (0.64) GHSRACE
SCHEMBL30051742 0.91 ACE (0.68) ACEECE1ERAP2LTA4HP2RY14
SCHEMBL31593292 0.90 GHSR (0.57) GHSRACE
SCHEMBL29925186 0.90 GHSR (0.60) GHSRACEECE1ERAP2
SCHEMBL31018785 0.90 ACE (0.62) GHSRACEECE1ERAP2ALOX15
SCHEMBL29924977 0.90 GHSR (0.60) GHSRACEECE1ERAP2
SCHEMBL30921655 0.90 GHSR (0.60) GHSRACEECE1ERAP2ALOX15
SCHEMBL31468798 0.90 GHSR (0.60) GHSRACEECE1ERAP2
SCHEMBL31593361 0.90 ACE (0.59) GHSRACEECE1ERAP2LTA4H
SCHEMBL29701396 0.90 GHSR (0.55) GHSRACELTA4HP2RY14

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-11471490-B2 T cells surface-loaded with immunostimulatory fusion molecules and uses thereof TORQUE THERAPEUTICS, INC. (US) 2022-10-18 — — US disclosed
US-20220195071-A1 IMMUNOTHERAPEUTIC COMPOSITIONS AND USE THEREOF TORQUE THERAPEUTICS, INC. 2022-06-23 — — 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-20220195071-A1 IMMUNOTHERAPEUTIC COMPOSITIONS AND USE THEREOF IL2, CD47, IFNG GHSR 3849/4885ACE 4259/4885ECE1 2952/4885
US-11471490-B2 T cells surface-loaded with immunostimulatory fusion molecules and uses thereof CD4, ICOS, IL2 GHSR 3241/4885ACE 3666/4885ECE1 2546/4885

“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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