SCHEMBL20138247

SCHEMBL20138247

CC(=O)N1CCCC(c2cc(F)c3c(c2)NC(=O)[C@@H](C)O3)C1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
PARP1 P09874 8/20 0.34
CDK9 P50750 2/20 0.33
CDK7 P50613 1/20 0.33
CCNT1 O60563 1/20 0.33
PROKR1 Q8TCW9 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
SCHEMBL20138191 0.95 PDE4B (0.37) TRPV1PARP1CDK9CDK7
SCHEMBL20138024 0.86 PARP1 (0.38) TRPV1PARP1CDK9CDK7
SCHEMBL18305068 0.82 PGR (0.38) TRPV1HPGDSMN1; SMN2MTNR1AMTNR1B
SCHEMBL20137956 0.78 HTR2A (0.34) TRPV1PARP1
SCHEMBL18305073 0.77 NR3C1 (0.39) TRPV1
Hydrochloric Acid SCHEMBL20137965 0.76 PARP1 (0.33) TRPV1PARP1
SCHEMBL28535412 0.70 BRD4 (0.39) CDK9CCNT1PROKR1
SCHEMBL20138149 0.69 BRD4 (0.31) PROKR1
SCHEMBL20138162 0.69 PROKR1 (0.35) CDK9CCNT1PROKR1
SCHEMBL20137992 0.69 TSHR (0.37) CDK9CCNT1PROKR1

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
CN-107873031-B Benzoxazinone derivatives and analogs thereof as modulators of TNF activity UCB生物制药私人有限公司 2021-03-12 CN disclosed
US-10287299-B2 Substituted benzo[b][1,4]oxazines and pyrido[3,2-b][1,4]oxazines as modulators of tumor necrosis factor activity UCB BIOPHARMA SPRL (BE) 2019-05-14 US disclosed
US-20180134728-A1 Benzoxazinone Derivatives and Analogues Thereof as Modulators of TNF Activity UCB S.A. (BE) 2018-05-17 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-20180134728-A1 Benzoxazinone Derivatives and Analogues Thereof as Modulators of TNF Activity TNF, NFKBIA, TNFRSF1A TRPV1 92/4885HPGD 54/4885SMN1; SMN2 798/4885
US-10287299-B2 Substituted benzo[b][1,4]oxazines and pyrido[3,2-b][1,4]oxazines as modulators of tumor necrosis factor activity TNF, TNFRSF1A, NFKBIA TRPV1 203/4885HPGD 385/4885SMN1; SMN2 419/4885

“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.