SCHEMBL7016792

SCHEMBL7016792

CCOC(=O)CC(C)N1CCC(C(=O)OCc2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
PKM P14618 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MAPT P10636 1/20 0.48
KDM4E B2RXH2 1/20 0.48
EGFR P00533 2/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
POLB P06746 1/20 0.47
CCR8 P51685 1/20 0.47
MMEL1 Q495T6 1/20 0.47

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
SCHEMBL23220928 0.83 SMN1; SMN2 (0.53) ALDH1A1PKMNPSR1SMN1; SMN2MAPT
SCHEMBL7248629 0.82 L3MBTL1 (0.62)
SCHEMBL7255633 0.81 KDM4E (0.56) ALDH1A1PKMNPSR1MEN1KMT2A
SCHEMBL7014898 0.79 MAPT (0.58) ALDH1A1PKMNPSR1MEN1KMT2A
SCHEMBL7016195 0.79 EGFR (0.69) ALDH1A1PKMNPSR1EGFRCCR8
SCHEMBL7016567 0.79 MAPT (0.41) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL8480400 0.77 EGFR (0.63) ALDH1A1PKMNPSR1MAPTEGFR
SCHEMBL7008455 0.77 NPSR1 (0.69) ALDH1A1PKMNPSR1MEN1KMT2A
SCHEMBL6222665 0.76 EGFR (0.59) ALDH1A1PKMNPSR1MEN1KMT2A
SCHEMBL13287204 0.76 SMN1; SMN2 (0.57) PKMNPSR1MEN1KMT2ASMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1224186-B1 PYRIDYL-CONTAINING SPIROCYCLIC COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION MILLENNIUM PHARM INC (US) 2003-09-24 EP disclosed
US-20030055244-A1 Pyridyl-containing spirocyclic compounds as inhibitors of fibrinogen-dependent platelet aggregation MILLENNIUM PHARMACEUTICALS, INC. 2003-03-20 US disclosed
EP-1224186-A2 PYRIDYL-CONTAINING SPIROCYCLIC COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION COR THERAPEUTICS, INC. (US) 2002-07-24 EP disclosed
WO-2001030780-A2 PYRIDYL-CONTAINING SPIROCYCLIC COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION COR THERAPEUTICS, INC. (US) 2001-05-03 WO 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-20030055244-A1 Pyridyl-containing spirocyclic compounds as inhibitors of fibrinogen-dependent platelet aggregation PF4, PFKP, FGB ALDH1A1 2226/4885PKM 2822/4885NPSR1 2595/4885

“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.