SCHEMBL1795281

SCHEMBL1795281

CCOc1ccccc1C1(Cl)C(=O)Nc2ccc(C#N)cc21

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.43
PGR P06401 6/20 0.40
RXFP1 Q9HBX9 1/20 0.39
TP53 P04637 2/20 0.36
PDE5A O76074 1/20 0.36
BACE1 P56817 1/20 0.36
AVPR1B P47901 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
BRD4 O60885 1/20 0.33

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
SCHEMBL17260322 0.88 TRPV4 (0.40) TRPV4PGRRXFP1TP53KMT2A
SCHEMBL2679504 0.87 KMT2A (0.47) PGRBACE1KMT2A
SCHEMBL17260266 0.85 AVPR1B (0.42) TRPV4PGRAVPR1BNPSR1KMT2A
SCHEMBL75334 0.84 PGR (0.40) TRPV4PGRRXFP1TP53PDE5A
SCHEMBL75146 0.84 KMT2A (0.50) TRPV4PGRRXFP1TP53PDE5A
SCHEMBL1479564 0.84 AVPR1B (0.39) TRPV4PGRAVPR1BKMT2ALMNA
SCHEMBL4590087 0.83 ADCY8 (0.43) PGRTP53KMT2A
SCHEMBL1465028 0.81 MAOB (0.41) PGRNPSR1KMT2ALMNA
SCHEMBL4510489 0.80 RXFP1 (0.42) TRPV4PGRRXFP1BACE1L3MBTL1
SCHEMBL73939 0.79 RXFP1 (0.38) TRPV4PGRRXFP1BACE1AVPR1B

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
US-8338590-B2 Substituted oxindole derivatives and medicaments containing the same ABBOTT GMBH & CO. KG (DE) 2012-12-25 US disclosed
US-20110257194-A1 SUBSTITUTED OXINDOL DERIVATIVES AND MEDICAMENTS CONTAINING THE SAME ABBOTT GMBH & CO. KG (DE) 2011-10-20 US disclosed
US-7951807-B2 Substituted oxindol derivatives and medicaments containing the same ABBOTT GMBH & CO. KG (DE) 2011-05-31 US disclosed
US-20090005397-A1 Substituted Oxindol Derivatives and Medicaments Containing the Same ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2009-01-01 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 (2 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-20090005397-A1 Substituted Oxindol Derivatives and Medicaments Containing the Same OXTR, AVPR2, AVPR1B TRPV4 445/4885PGR 412/4885RXFP1 35/4885
US-20110257194-A1 SUBSTITUTED OXINDOL DERIVATIVES AND MEDICAMENTS CONTAINING THE SAME OXTR, AVPR2, AVPR1B TRPV4 643/4885PGR 480/4885RXFP1 55/4885

“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.