SCHEMBL29970949

SCHEMBL29970949

C[C@@H]1c2ccsc2CCN1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.59
HHAT Q5VTY9 5/20 0.56
KMT2A Q03164 1/20 0.52
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
LHCGR P22888 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
SCHEMBL8026128 0.80 DRD1 (0.52) DRD1HHATKMT2AMAPK1NPSR1
SCHEMBL8028051 0.80 DRD1 (0.52) DRD1HHATKMT2AMAPK1NPSR1
SCHEMBL1863899 0.80 DRD1 (0.52) DRD1HHATKMT2AMAPK1NPSR1
SCHEMBL28449155 0.76 KMT2A (0.40) DRD1HHATKMT2A
SCHEMBL29970524 0.75 SMN1; SMN2 (0.37) DRD1HHATKMT2AMAPK1
SCHEMBL22044650 0.74 KMT2A (0.51) DRD1HHATKMT2A
SCHEMBL29971027 0.74 SMN1; SMN2 (0.36) DRD1HHATKMT2A
SCHEMBL14096426 0.72 DRD1 (0.53) DRD1KMT2AMAPK1NPSR1LHCGR
SCHEMBL21465733 0.72 DRD1 (0.60) DRD1HHAT
SCHEMBL30878500 0.72 DRD1 (0.60) DRD1HHAT

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
EP-3746444-B1 CYCLOALKYL SUBSTITUTED PYRAZOLOPYRIMIDINES HAVING ACTIVITY AGAINST RSV JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) 2023-09-27 EP disclosed
US-11491157-B2 Cycloalkyl substituted pyrazolopyrimidines having activity against RSV Janssen Sciences Ireland Unlimited Company Co Cork, IE (IE) 2022-11-08 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-11491157-B2 Cycloalkyl substituted pyrazolopyrimidines having activity against RSV ACE, ACE2, PTBP1 DRD1 3977/4885HHAT 2436/4885KMT2A 3441/4885

“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.