SCHEMBL3842297

SCHEMBL3842297

O=C1OC2(CCNCC2)c2ccc(Br)cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 4/20 0.50
NPY5R Q15761 2/20 0.45
SIGMAR1 Q99720 3/20 0.41
HTR2C P28335 1/20 0.40
PARP1 P09874 1/20 0.40
PARP10 Q53GL7 1/20 0.40
DRD2 P14416 1/20 0.38
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TDP2 O95551 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 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
SCHEMBL18373156 0.88 NPY5R (0.45) AVPR1ANPY5RSIGMAR1HTR2CPARP1
SCHEMBL31394077 0.83 AVPR1A (0.51) AVPR1ANPY5RSIGMAR1PARP1PARP10
SCHEMBL654562 0.82 NPY5R (0.45) AVPR1ANPY5RSIGMAR1HTR2CPARP1
SCHEMBL738397 0.82 AVPR1A (0.50) AVPR1ANPY5RSIGMAR1HTR2CPARP1
Hydrochloric Acid SCHEMBL6820620 0.81 AVPR1A (0.49) AVPR1ANPY5RSIGMAR1HTR2CPARP1
SCHEMBL31394738 0.80 AVPR1A (0.47) AVPR1ANPY5RSIGMAR1PARP1PARP10
SCHEMBL17586455 0.79 OPRM1 (0.41) AVPR1ANPY5RSIGMAR1HTR2CPARP1
SCHEMBL3839594 0.79 AVPR1A (0.60) AVPR1ANPY5RSIGMAR1DRD2
SCHEMBL171980 0.79 SIGMAR1 (0.54) AVPR1ANPY5RSIGMAR1
SCHEMBL29674557 0.79 SIGMAR1 (0.54) AVPR1ANPY5RSIGMAR1

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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066378-A1 SPIRO-OXAZOLONES HOFFMANN-LA ROCHE INC. (US) 2025-02-27 US disclosed
US-12162887-B2 Spiro-oxazolones HOFFMANN-LA ROCHE INC. (US) 2024-12-10 US disclosed
US-20230106150-A1 SPIRO-OXAZOLONES HOFFMANN-LA ROCHE INC. (US) 2023-04-06 US disclosed
US-20200039997-A1 SPIRO-OXAZOLONES HOFFMANN-LA ROCHE INC. (US) 2020-02-06 US disclosed
US-10479796-B2 Spiro-oxazolones HOFFMAN-LA ROCHE INC. (US) 2019-11-19 US disclosed
EP-3107916-B1 SPIRO-OXAZOLONES HOFFMANN LA ROCHE (CH) 2019-03-20 EP disclosed
EP-3083633-B1 SPIRO-OXAZOLONES HOFFMANN LA ROCHE (CH) 2017-11-29 EP disclosed
US-9828385-B2 Spiro-oxazolones HOFFMANN-LA ROCHE INC. (US) 2017-11-28 US disclosed
US-20170008901-A1 SPIRO-OXAZOLONES HOFFMANN-LA ROCHE INC. (US) 2017-01-12 US disclosed
EP-3107916-A1 SPIRO-OXAZOLONES F. Hoffmann-La Roche AG (CH) 2016-12-28 EP disclosed
US-20080146557-A1 INDOL-3-YL-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS VIa RECEPTOR ANTAGONISTS BISSANTZ CATERINA 2008-06-19 US disclosed
EP-1904477-A1 INDOL-3-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS V1A RECEPTOR ANTAGONISTS F. Hoffmann-Roche AG (CH) 2008-04-02 EP disclosed
US-7332501-B2 Indol-3-yl-carbonyl-spiro-piperidine derivatives as V1a receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2008-02-19 US disclosed
US-7332501-B2 Indol-3-yl-carbonyl-spiro-piperidine derivatives as V1a receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2008-02-19 US disclosed
US-7332501-B2 Indol-3-yl-carbonyl-spiro-piperidine derivatives as V1a receptor antagonists HOFFMANN-LA ROCHE INC. (US) 2008-02-19 US disclosed
US-20070027173-A1 Indol-3-yl-carbonyl-spiro-piperidine derivatives as Vla receptor antagonists F. HOFFMANN-LA ROCHE AG (CH) 2007-02-01 US disclosed
US-20070027173-A1 Indol-3-yl-carbonyl-spiro-piperidine derivatives as Vla receptor antagonists F. HOFFMANN-LA ROCHE AG (CH) 2007-02-01 US disclosed
US-20070027173-A1 Indol-3-yl-carbonyl-spiro-piperidine derivatives as Vla receptor antagonists F. HOFFMANN-LA ROCHE AG (CH) 2007-02-01 US disclosed
WO-2007006688-A1 INDOL-3-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS V1A RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2007-01-18 WO disclosed
WO-2007006688-A1 INDOL-3-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS V1A RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2007-01-18 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 (8 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-20070027173-A1 Indol-3-yl-carbonyl-spiro-piperidine derivatives as Vla receptor antagonists AVPR1A, AVPR2, AVPR1B AVPR1A 1/4885NPY5R 200/4885SIGMAR1 44/4885
US-12162887-B2 Spiro-oxazolones AVPR1A, AVPR1B, AVPR2 AVPR1A 1/4885NPY5R 162/4885SIGMAR1 178/4885
US-20250066378-A1 SPIRO-OXAZOLONES AVPR1A, AVPR1B, AVPR2 AVPR1A 1/4885NPY5R 162/4885SIGMAR1 178/4885
US-20200039997-A1 SPIRO-OXAZOLONES AVPR1A, AVPR1B, AVPR2 AVPR1A 1/4885NPY5R 162/4885SIGMAR1 178/4885
US-20170008901-A1 SPIRO-OXAZOLONES AVPR1A, AVPR1B, AVPR2 AVPR1A 1/4885NPY5R 162/4885SIGMAR1 178/4885
US-20080146557-A1 INDOL-3-YL-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS VIa RECEPTOR ANTAGONISTS AVPR1A, AVPR2, OXTR AVPR1A 1/4885NPY5R 79/4885SIGMAR1 53/4885
US-20230106150-A1 SPIRO-OXAZOLONES AVPR1A, AVPR1B, AVPR2 AVPR1A 1/4885NPY5R 162/4885SIGMAR1 178/4885
US-10479796-B2 Spiro-oxazolones AVPR1A, AVPR1B, AVPR2 AVPR1A 1/4885NPY5R 162/4885SIGMAR1 178/4885

“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.