SCHEMBL4955202

SCHEMBL4955202

Cc1cc2nccc(N3CCC(c4nccs4)CC3)n2n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 2/20 0.39
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
AOC3 Q16853 2/20 0.37
POLB P06746 1/20 0.36
MAPK8 P45983 1/20 0.35
MAPK10 P53779 1/20 0.35
BTK Q06187 1/20 0.35
MRGPRX2 Q96LB1 1/20 0.35
NPC1 O15118 2/20 0.34
SMPD3 Q9NY59 1/20 0.34
SPR P35270 2/20 0.33
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GPR39 O43194 1/20 0.31
ATR Q13535 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
SCHEMBL3063005 0.78 SPR (0.39) HTTMEN1KMT2APOLBMAPK8
SCHEMBL12539252 0.68 DRD4 (0.43) DRD4AOC3SPR
SCHEMBL16421204 0.67 KDM4E (0.50) HTTMEN1KMT2APOLBNPC1
SCHEMBL498175 0.65
SCHEMBL15025455 0.65 DRD4 (0.41) DRD4AOC3POLBSPRALDH1A1
SCHEMBL3654356 0.64 DRD4 (0.41) DRD4AOC3POLBNPC1SPR
SCHEMBL27316784 0.64 HRH3 (0.42) DRD4AOC3SPR
SCHEMBL13407392 0.64 DRD4 (0.49) DRD4MEN1KMT2AAOC3SPR
SCHEMBL18788184 0.64 HTT (0.41) HTTMEN1KMT2APOLBNPC1
SCHEMBL418629 0.63 KDM4E (0.47) ALDH1A1L3MBTL1

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-20080241100-A1 PHARMACEUTICAL COMPOSITION COMPRISING A CYTOKINE 4SC AG (DE) 2008-10-02 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-20080241100-A1 PHARMACEUTICAL COMPOSITION COMPRISING A CYTOKINE IL2, IL17A, IFNG DRD4 3656/4885HTT 2080/4885MEN1 2060/4885

“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.