SCHEMBL2476740

SCHEMBL2476740

O=C1N(c2ccc(Br)cc2)CCC12CCOCC2

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.56
EBP Q15125 1/20 0.48
EGLN1 Q9GZT9 2/20 0.45
AKR1C3 P42330 1/20 0.41
ITGB3 P05106 5/20 0.40
ITGA2B P08514 5/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.38
LIPE Q05469 1/20 0.38
CNR1 P21554 1/20 0.37

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
SCHEMBL2474912 0.91 HRH3 (0.51) HRH3EBPEGLN1AKR1C3ITGB3
SCHEMBL29348863 0.87 HRH3 (0.43) HRH3EBPEGLN1AKR1C3ITGB3
SCHEMBL22396051 0.81 HRH3 (0.43) HRH3EBPEGLN1ITGB3ITGA2B
SCHEMBL2633806 0.79 AKR1C3 (0.46) HRH3EBPEGLN1AKR1C3
SCHEMBL2473880 0.77 MEN1 (0.42) HRH3EGLN1MEN1KMT2AHSD17B10
SCHEMBL2476781 0.77 HRH3 (0.43) HRH3EBPEGLN1
SCHEMBL21490337 0.77 HDAC11 (0.42) HRH3EGLN1ITGB3ITGA2BMEN1
SCHEMBL29443074 0.77 HDAC11 (0.42) HRH3EGLN1ITGB3ITGA2BMEN1
SCHEMBL24743012 0.76 RORC (0.47) HRH3EBPEGLN1ITGB3ITGA2B
SCHEMBL14760991 0.76 HRH3 (0.73) HRH3EBPEGLN1ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2373659-B1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-07-30 EP disclosed
EP-2373659-B1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-07-30 EP disclosed
US-8383814-B2 Substituted tetrahydropyran spiro pyrrolidinone and piperidinone, preparation and therapeutic use thereof SANOFI (FR) 2013-02-26 US disclosed
US-8383814-B2 Substituted tetrahydropyran spiro pyrrolidinone and piperidinone, preparation and therapeutic use thereof SANOFI (FR) 2013-02-26 US disclosed
US-8383814-B2 Substituted tetrahydropyran spiro pyrrolidinone and piperidinone, preparation and therapeutic use thereof SANOFI (FR) 2013-02-26 US disclosed
US-20120238757-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-09-20 US disclosed
US-20120238757-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-09-20 US disclosed
US-20120238757-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-09-20 US disclosed
US-8217052-B2 Substituted tetrahydropyran spiro pyrrolidinone and piperidinone, preparation and therapeutic use thereof SANOFI (FR) 2012-07-10 US disclosed
US-8217052-B2 Substituted tetrahydropyran spiro pyrrolidinone and piperidinone, preparation and therapeutic use thereof SANOFI (FR) 2012-07-10 US disclosed
US-8217052-B2 Substituted tetrahydropyran spiro pyrrolidinone and piperidinone, preparation and therapeutic use thereof SANOFI (FR) 2012-07-10 US disclosed
US-20110251225-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-10-13 US disclosed
US-20110251225-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-10-13 US disclosed
US-20110251225-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-10-13 US disclosed
EP-2373659-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-10-12 EP disclosed
WO-2010065798-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-06-10 WO disclosed
WO-2010065798-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-06-10 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 (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-20110251225-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF HRH3, HRH4, HRH1 HRH3 1/4885EBP 2737/4885EGLN1 545/4885
US-20120238757-A1 SUBSTITUTED TETRAHYDROPYRAN SPIRO PYRROLIDINONE AND PIPERIDINONE, PREPARATION AND THERAPEUTIC USE THEREOF HRH3, HRH4, HRH1 HRH3 1/4885EBP 2737/4885EGLN1 545/4885

“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.