SCHEMBL16410

SCHEMBL16410

COc1cc(OCC2CC2)ccc1F

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 4/20 0.52
▸ PARP15 Q460N3 3/20 0.52
▸ TDP1 Q9NUW8 1/20 0.46
▸ S1PR1 P21453 1/20 0.45
▸ FFAR4 Q5NUL3 1/20 0.44
▸ PDE4A P27815 1/20 0.43
▸ PDE4D Q08499 1/20 0.43
▸ FFAR1 O14842 4/20 0.43

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
SCHEMBL27929864 0.87 PARP10 (0.49) PARP10PARP15TDP1PDE4APDE4D
SCHEMBL14901056 0.81 PARP10 (0.55) PARP10PARP15FFAR4
SCHEMBL1697560 0.81 PARP15 (0.52) PARP10PARP15TDP1PDE4APDE4D
SCHEMBL10187096 0.81 PARP15 (0.52) PARP10PARP15TDP1PDE4APDE4D
SCHEMBL29040215 0.80 PARP10 (0.48) PARP10PARP15TDP1FFAR4
SCHEMBL22479881 0.80 PARP10 (0.48) PARP10PARP15FFAR4
SCHEMBL30495513 0.80 PARP10 (0.48) PARP10PARP15TDP1FFAR4
SCHEMBL24685887 0.78 NQO1 (0.48) FFAR4FFAR1
SCHEMBL16900529 0.78 CA12 (0.42) PARP10PARP15TDP1
SCHEMBL9223680 0.77 PARP10 (0.49) PARP10PARP15FFAR4FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609065-B1 PROCESSES FOR PRODUCING 1-BROMO-2 (CYCLOPROPYL METHOXY)-5 FLUORO-4- METHOXYBENZENE ALBEMARLE CORP (US) 2015-07-08 — — EP claimed
EP-2609065-A1 PROCESSES FOR PRODUCING 1-BROMO-2 (CYCLOPROPYL METHOXY)-5 FLUORO-4- METHOXYBENZENE Albemarle Corporation (US) 2013-07-03 — — EP claimed
US-20130109887-A1 PROCESSES FOR PRODUCING 1-BROMO-2- (CYCLOPROPYL METHOXY)-5-FLUORO-4-METHOXYBENZENE ALBERMARLE CORPORATION (US) 2013-05-02 — — US claimed
WO-2012027134-A1 PROCESSES FOR PRODUCING 1-BROMO-2 (CYCLOPROPYL METHOXY)-5 FLUORO-4- METHOXYBENZENE ALBEMARLE CORPORATION (US) 2012-03-01 — — WO claimed
EP-2609065-B1 PROCESSES FOR PRODUCING 1-BROMO-2 (CYCLOPROPYL METHOXY)-5 FLUORO-4- METHOXYBENZENE ALBEMARLE CORP (US) 2015-07-08 — — EP disclosed
EP-2609065-A1 PROCESSES FOR PRODUCING 1-BROMO-2 (CYCLOPROPYL METHOXY)-5 FLUORO-4- METHOXYBENZENE Albemarle Corporation (US) 2013-07-03 — — EP disclosed
US-20130109887-A1 PROCESSES FOR PRODUCING 1-BROMO-2- (CYCLOPROPYL METHOXY)-5-FLUORO-4-METHOXYBENZENE ALBERMARLE CORPORATION (US) 2013-05-02 — — US disclosed
US-20130109887-A1 PROCESSES FOR PRODUCING 1-BROMO-2- (CYCLOPROPYL METHOXY)-5-FLUORO-4-METHOXYBENZENE ALBERMARLE CORPORATION (US) 2013-05-02 — — US disclosed
US-20130109887-A1 PROCESSES FOR PRODUCING 1-BROMO-2- (CYCLOPROPYL METHOXY)-5-FLUORO-4-METHOXYBENZENE ALBERMARLE CORPORATION (US) 2013-05-02 — — US disclosed
WO-2012027134-A1 PROCESSES FOR PRODUCING 1-BROMO-2 (CYCLOPROPYL METHOXY)-5 FLUORO-4- METHOXYBENZENE ALBEMARLE CORPORATION (US) 2012-03-01 — — 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-20130109887-A1 PROCESSES FOR PRODUCING 1-BROMO-2- (CYCLOPROPYL METHOXY)-5-FLUORO-4-METHOXYBENZENE CYP4B1, CYP4X1, CYP1B1 PARP10 847/4885PARP15 186/4885TDP1 3218/4885

“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.

Send feedback