SCHEMBL9822301

SCHEMBL9822301

OC1CCCc2c(Cl)cccc21

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.44
UGT2B17 O75795 2/20 0.43
HTR2C P28335 1/20 0.42
TAS1R3 Q7RTX0 4/20 0.41
TAS1R1 Q7RTX1 4/20 0.41
TAS1R2 Q8TE23 4/20 0.41
OPRM1 P35372 3/20 0.40
OPRL1 P41146 3/20 0.40
BRD3 Q15059 1/20 0.39
ACHE P22303 1/20 0.39
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
GRM5 P41594 3/20 0.37
ALDH1A1 P00352 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
SCHEMBL29325484 0.95 HTR2C (0.41) KMT2AUGT2B17HTR2CTAS1R3TAS1R1
SCHEMBL11110438 0.89 HTR2C (0.45) HTR2CTAS1R3TAS1R1TAS1R2OPRM1
SCHEMBL1508379 0.89 HTR2C (0.45) HTR2CTAS1R3TAS1R1TAS1R2OPRM1
SCHEMBL1508419 0.89 HTR2C (0.45) HTR2CTAS1R3TAS1R1TAS1R2OPRM1
SCHEMBL454127 0.79 ADRA2A (0.51) KMT2AUGT2B17TAS1R3TAS1R1TAS1R2
SCHEMBL12014020 0.79 UGT2B17 (0.58) KMT2AUGT2B17HTR2CTAS1R3TAS1R1
SCHEMBL29644747 0.79 ADRA2A (0.51) KMT2AUGT2B17TAS1R3TAS1R1TAS1R2
SCHEMBL1151017 0.78 HTR2C (0.42) HTR2CTAS1R3TAS1R1TAS1R2OPRM1
SCHEMBL13974016 0.78 KMT2A (0.44) KMT2AUGT2B17BRD3ACHEGRM5
SCHEMBL2422836 0.78 UGT2B17 (0.47) KMT2AUGT2B17TAS1R3TAS1R1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200061063-A1 BICYCLICALLY SUBSTITUTED URACILS AND THE USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-02-27 US disclosed
CN-106983751-B Bicyclic substituted uracils and their use 拜耳医药股份有限公司 2020-01-07 CN disclosed
US-10300062-B2 Bicyclically substituted uracils and the use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-05-28 US disclosed
US-20180256576-A1 BICYCLICALLY SUBSTITUTED URACILS AND THE USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-09-13 US disclosed
US-9949978-B2 Bicyclically substituted uracils and the use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-04-24 US disclosed
US-9949977-B2 Bicyclically substituted uracils and the use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-04-24 US disclosed
EP-3045456-B1 BICYCLIC SUBSTITUTED URACILS AND THEIR USE Bayer Pharma AG (DE) 2017-10-25 EP disclosed
US-20170267648-A1 SUBSTITUTED URACILS AS CHYMASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-09-21 US disclosed
US-9751843-B2 Substituted uracils and use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-09-05 US disclosed
US-9695131-B2 Substituted uracils as chymase inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-07-04 US disclosed
EP-2847190-A1 BICYCLICALLY SUBSTITUTED URACILS AND THE USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2015-03-18 EP disclosed
WO-2013167495-A1 BICYCLICALLY SUBSTITUTED URACILS AND THE USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2013-11-14 WO disclosed
EP-0230967-B1 BENZAZECINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1991-10-23 EP disclosed
CN-1013111-B The method for preparing Benzazecin derivative HOFFMANN LA ROCHE (CH) 1991-07-10 CN disclosed
US-4957911-A LEARNING ENHANCEMENT HOFFMANN-LA ROCHE INC. (US) 1990-09-18 US disclosed
US-4876340-A Benzazecine derivatives for cognitive and memory functions HOFFMANN-LA ROCHE INC. (US) 1989-10-24 US disclosed
US-4749791-A Benzo[f]quinoline intermediates HOFFMANN-LA ROCHE INC. (US) 1988-06-07 US disclosed
US-4732979-A CEREBRAL INSUFFICIENCY HOFFMANN-LA ROCHE INC. (US) 1988-03-22 US disclosed
CN-87100312-A Benzacyclodecane derivatives 1987-09-09 CN disclosed
EP-0230967-A2 Benzazecine derivatives F. HOFFMANN-LA ROCHE AG (CH) 1987-08-05 EP 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 (4 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-20170267648-A1 SUBSTITUTED URACILS AS CHYMASE INHIBITORS CMA1, UNG, TYMP KMT2A 3644/4885UGT2B17 1271/4885HTR2C 2976/4885
US-10300062-B2 Bicyclically substituted uracils and the use thereof UNG, UMPS, TYMP KMT2A 2888/4885UGT2B17 184/4885HTR2C 3534/4885
US-20200061063-A1 BICYCLICALLY SUBSTITUTED URACILS AND THE USE THEREOF UNG, UMPS, TYMP KMT2A 2888/4885UGT2B17 184/4885HTR2C 3534/4885
US-20180256576-A1 BICYCLICALLY SUBSTITUTED URACILS AND THE USE THEREOF UNG, UMPS, TYMP KMT2A 2888/4885UGT2B17 184/4885HTR2C 3534/4885

“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.