SCHEMBL428192

SCHEMBL428192

CC(C)(C)c1ccccc1N1CCC1=O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 11/20 0.46
P2RX7 Q99572 1/20 0.41
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
SRD5A1 P18405 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL4438490 0.94 RBP4 (0.42) RBP4P2RX7DDB1CRBNSRD5A1
SCHEMBL19937828 0.90 RBP4 (0.44) RBP4P2RX7CYP2D6CYP2C9
SCHEMBL19962678 0.82 MEN1 (0.45) P2RX7CYP2D6CYP2C9
SCHEMBL25667165 0.80 CRBN (0.65) RBP4DDB1CRBN
SCHEMBL2051520 0.78 RBP4 (0.45) RBP4SMN1; SMN2
SCHEMBL25666659 0.78 CRBN (0.47) RBP4P2RX7DDB1CRBN
SCHEMBL30858424 0.76 DDB1 (0.64) P2RX7DDB1CRBNSMN1; SMN2
SCHEMBL11513544 0.74 ALOX5 (0.50) P2RX7DDB1CRBN
SCHEMBL14495113 0.73 KEAP1 (0.48) DDB1CRBNSRD5A1SMN1; SMN2
SCHEMBL3289324 0.72 MGLL (0.47) P2RX7DDB1CRBNSRD5A1SMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130165479-A1 ANTAGONISTS OF THE TRPV1 RECEPTOR AND USES THEREOF ABBVIE, INC. (US) 2013-06-27 US disclosed
US-8350083-B2 Antagonists of the TRPV1 receptor and uses thereof ABBVIE INC. (US) 2013-01-08 US disclosed
EP-2450346-A1 Antagonists of the TRPV1 receptor and uses thereof Abbott Laboratories (US) 2012-05-09 EP disclosed
US-20120022103-A1 ANTAGONISTS OF THE TRPV1 RECEPTOR AND USES THEREOF ABBOTT LABORATORIES (US) 2012-01-26 US disclosed
US-8030504-B2 Pain, especially, inflammatory hyperalgesia, ostheoarthritic pain, chronic lower pain, allodynia, migraine. Methods of controlling pain and treating bladder overactivity and urinary incontinence ABBOTT LABORATORIES (US) 2011-10-04 US disclosed
US-20080153871-A1 ANTAGONISTS OF THE TRPV1 RECEPTOR AND USES THEREOF ABBOTT LABORATORIES (US) 2008-06-26 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 (3 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-20080153871-A1 ANTAGONISTS OF THE TRPV1 RECEPTOR AND USES THEREOF TRPV1, TRPV3, TRPV2 RBP4 2032/4885P2RX7 158/4885DDB1 4720/4885
US-20130165479-A1 ANTAGONISTS OF THE TRPV1 RECEPTOR AND USES THEREOF TRPV1, TRPV3, TRPV2 RBP4 2305/4885P2RX7 158/4885DDB1 4703/4885
US-20120022103-A1 ANTAGONISTS OF THE TRPV1 RECEPTOR AND USES THEREOF TRPV1, TRPV3, TRPV2 RBP4 2032/4885P2RX7 158/4885DDB1 4720/4885

“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.