SCHEMBL17595034

SCHEMBL17595034

O=C1CCN(Cc2ccc3ccccc3n2)CC1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.56
HTR1A P08908 1/20 0.53
HTR7 P34969 1/20 0.53
PTPN1 P18031 1/20 0.46
OPRL1 P41146 1/20 0.46
MCHR1 Q99705 1/20 0.46
DRD4 P21917 1/20 0.45
BCHE P06276 1/20 0.45
ACHE P22303 1/20 0.45
HCRTR1 O43613 4/20 0.44
HCRTR2 O43614 4/20 0.44

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
SCHEMBL17289123 0.87 FAAH (0.65) FAAHHTR1AHTR7OPRL1MCHR1
SCHEMBL1331198 0.87 FAAH (0.65) FAAHHTR1AHTR7OPRL1MCHR1
SCHEMBL27140396 0.82 FAAH (0.57) FAAHHTR1AHTR7MCHR1DRD4
SCHEMBL6584608 0.82 FAAH (0.60) FAAHHTR1AHTR7MCHR1DRD4
SCHEMBL28824423 0.81 FAAH (0.56) FAAHHTR1AHTR7OPRL1MCHR1
SCHEMBL6584428 0.80 FAAH (0.59) FAAHHTR1AHTR7OPRL1MCHR1
SCHEMBL1331766 0.79 HRH3 (0.63) FAAHHTR1AHTR7MCHR1DRD4
SCHEMBL2170401 0.79 CYP3A4 (0.55) FAAHHTR1AHTR7DRD4
SCHEMBL31061967 0.79 CXCR4 (0.65) FAAHHTR1AHTR7DRD4
SCHEMBL21066574 0.79 CXCR4 (0.65) FAAHHTR1AHTR7DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3191483-B1 COMPOUNDS AS CRTH2 ANTAGONIST AND USES THEREOF NORTH & SOUTH BROTHER PHARMACY INVESTMENT CO LTD (CN) 2020-06-10 EP disclosed
US-9951010-B2 Compounds as CRTH2 antagonist and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2018-04-24 US disclosed
US-20170267634-A1 COMPOUNDS AS CRTH2 ANTAGONIST AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-09-21 US disclosed
EP-3191483-A1 COMPOUNDS AS CRTH2 ANTAGONIST AND USES THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2017-07-19 EP disclosed
WO-2016037591-A1 COMPOUNDS AS CRTH2 ANTAGONIST AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-03-17 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 (1 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-20170267634-A1 COMPOUNDS AS CRTH2 ANTAGONIST AND USES THEREOF HRH2, PTGDR2, HRH1 FAAH 144/4885HTR1A 467/4885HTR7 476/4885

“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.