SCHEMBL7076353

SCHEMBL7076353

CC1CC(c2ccccc2)CCN1n1ccc2cc(C(N)=O)ccc21

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 4/20 0.39
PARP10 Q53GL7 3/20 0.39
USP5 P45974 1/20 0.39
ROCK2 O75116 1/20 0.38
PIM1 P11309 1/20 0.38
PIM3 Q86V86 1/20 0.38
JAK2 O60674 8/20 0.36
JAK1 P23458 8/20 0.36
TYK2 P29597 8/20 0.36
JAK3 P52333 8/20 0.36
F2 P00734 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35

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
SCHEMBL5374213 0.83 F2 (0.50) PARP14F2OPRM1OPRD1
SCHEMBL5732645 0.73 F2 (0.50) PARP14F2OPRM1OPRD1
SCHEMBL7076354 0.72 MMP2 (0.39) PARP14PARP10USP5CA12CA1
SCHEMBL5203573 0.69 F2 (0.57) PARP14F2CA12CA1CA2
SCHEMBL7375632 0.67 ROCK2 (0.46) ROCK2PIM1PIM3JAK2JAK1
SCHEMBL7509753 0.64 ROCK2 (0.46) ROCK2PIM1PIM3OPRM1OPRD1
SCHEMBL5734925 0.64 F2 (0.47) ROCK2PIM1PIM3F2
SCHEMBL27303418 0.63 PARP10 (0.46) PARP14PARP10CA12CA1CA2
SCHEMBL5733400 0.63 ROCK2 (0.41) ROCK2PIM1PIM3JAK2JAK1
SCHEMBL30098896 0.63 AR (0.64) ROCK2PIM1PIM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030073699-A1 Compounds and methods to treat cardiac failure and other disorders SCIOS, INC. 2003-04-17 US disclosed
US-6340685-B1 ANTIINFLAMMATORY AGENTS SCIOS, INC. 2002-01-22 US disclosed
US-6130235-A PIPERIDINE MOIETIES COUPLED TO INDOLE, BENZIMIDAZOLE OR BENZOTRIAZOLE. SCIOS INC. (US) 2000-10-10 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-20030073699-A1 Compounds and methods to treat cardiac failure and other disorders RCOR1, NR3C2, CNR1 PARP14 2130/4885PARP10 2873/4885USP5 4517/4885

“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.