SCHEMBL32684016

SCHEMBL32684016

O=C(O)[C@H](Cc1c[nH]c2c(Cl)cccc12)NBr

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 8/20 0.50
ICAM1 P05362 8/20 0.50
ITGAL P20701 8/20 0.50
TNF P01375 1/20 0.49
HTR2A P28223 1/20 0.48
NR4A2 P43354 1/20 0.45
RIPK1 Q13546 3/20 0.44
ALOX15 P16050 1/20 0.44
SLC6A4 P31645 1/20 0.43
ACE P12821 1/20 0.43

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
SCHEMBL837759 0.87 ITGB2 (0.53) ITGB2ICAM1ITGALTNFHTR2A
SCHEMBL837864 0.85 TNF (0.68) ITGB2ICAM1ITGALTNFNR4A2
SCHEMBL836657 0.85 TNF (0.68) ITGB2ICAM1ITGALTNFNR4A2
SCHEMBL24328355 0.81 SMN1; SMN2 (0.61) ITGB2ICAM1ITGALTNFHTR2A
SCHEMBL3467251 0.80 TNF (0.64) TNFHTR2ANR4A2RIPK1ALOX15
SCHEMBL18028962 0.80 TNF (0.64) TNFHTR2ANR4A2RIPK1ALOX15
SCHEMBL30495964 0.80 TNF (0.64) TNFHTR2ANR4A2RIPK1ALOX15
SCHEMBL837413 0.80 TNF (0.64) TNFHTR2ANR4A2RIPK1ALOX15
SCHEMBL838121 0.80 TNF (0.64) TNFHTR2ANR4A2RIPK1ALOX15
SCHEMBL31407308 0.79 ACE (0.56) ITGB2ICAM1ITGALTNFACE

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-20260071243-A1 BIOLOGICAL PRODUCTION OF TRYPTOPHAN-DERIVED PRODUCTS UNIV TEXAS (US) 2026-03-12 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-20260071243-A1 BIOLOGICAL PRODUCTION OF TRYPTOPHAN-DERIVED PRODUCTS TPH1, TPH2, SLC6A4 ITGB2 4874/4885ICAM1 4827/4885ITGAL 4672/4885

“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.