SCHEMBL29690179

SCHEMBL29690179

Cc1c(Cl)cccc1-c1nc2c(s1)C=NCC2

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 8/20 0.38
CD274 Q9NZQ7 8/20 0.38
HTR2C P28335 1/20 0.37
IDO1 P14902 1/20 0.35
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31
CNR2 P34972 1/20 0.31
ALDH1A1 P00352 3/20 0.30
TDP1 Q9NUW8 2/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL20329029 0.75 PDCD1 (0.47) PDCD1CD274ALDH1A1NPC1MAPT
SCHEMBL20324274 0.71 PDCD1 (0.66) PDCD1CD274IDO1
SCHEMBL20295946 0.69 PDCD1 (0.51) PDCD1CD274HTR2CCNR2
SCHEMBL20296251 0.69 GRM5 (0.47) PDCD1CD274HTR2C
SCHEMBL31711064 0.66 HTR2C (0.45) PDCD1CD274HTR2CNPC1RAB9A
SCHEMBL20294344 0.64 PDCD1 (0.43) PDCD1CD274HTR2CNPC1RAB9A
SCHEMBL30145307 0.64 PDCD1 (0.43) PDCD1CD274HTR2CNPC1RAB9A
SCHEMBL19569144 0.63 DCK (0.36) HTR2CIDO1ALDH1A1NPC1MAPT
SCHEMBL30836868 0.62 MAOB (0.38)
SCHEMBL10336938 0.61 CTSA (0.45) IDO1ALDH1A1RAB9AL3MBTL1

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-11339149-B2 Heterocyclic compounds as immunomodulators INCYTE CORPORATION (US) 2022-05-24 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-11339149-B2 Heterocyclic compounds as immunomodulators CD74, IL2, ICOS PDCD1 157/4885CD274 88/4885HTR2C 2942/4885

“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.