SCHEMBL318842

SCHEMBL318842

Cc1ccc(F)c(-c2c(F)cccc2F)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 2/20 0.38
▸ CCR8 P51685 1/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ NOS3 P29474 1/20 0.35
▸ NOS2 P35228 1/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ SENP8 Q96LD8 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ SENP6 Q9GZR1 1/20 0.35
▸ TGFBR1 P36897 4/20 0.34
▸ ACHE P22303 1/20 0.34
▸ CCR5 P51681 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ METAP2 P50579 1/20 0.34
▸ S100A4 P26447 1/20 0.34
▸ NSD2 O96028 1/20 0.34
▸ G6PD P11413 1/20 0.34

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
SCHEMBL1711752 0.74 TGFBR1 (0.38) RAB9ANPC1TGFBR1CYP1A2NSD2
SCHEMBL18807016 0.72 CCR1 (0.62) CCR1CCR8NOS3NOS2TGFBR1
SCHEMBL15883642 0.72 PIM2 (0.44) —
SCHEMBL19240430 0.71 S1PR4 (0.34) —
SCHEMBL18259260 0.71 CCR1 (0.41) CCR1L3MBTL1RAB9ANPC1CASP3
SCHEMBL18259430 0.71 CCR1 (0.41) CCR1L3MBTL1TDP1RAB9ANPC1
SCHEMBL27997101 0.70 TGFBR1 (0.40) RAB9ANPC1TGFBR1NSD2G6PD
SCHEMBL21083452 0.69 MAPT (0.45) L3MBTL1TDP1TGFBR1METAP2S100A4
SCHEMBL318608 0.69 KDM4E (0.50) TDP1
SCHEMBL15894764 0.69 PIM2 (0.37) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112794860-B Oxazole pyrimidone amide compound or medicinal salt thereof, preparation method and application 上海肇钰医药科技有限公司 2021-06-29 — — CN disclosed
CN-112794860-A Oxazole pyrimidone amide compound or medicinal salt thereof, preparation method and application 上海肇钰医药科技有限公司 2021-05-14 — — CN disclosed
EP-2861585-B1 NOVEL RING-SUBSTITUTED N-PYRIDINYL AMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2019-01-09 — — EP disclosed
CN-104334546-B Novel ring-substituted N-pyridyl amides as kinase inhibitors 诺华股份有限公司 2017-05-03 — — CN disclosed
WO-2017045615-A1 PYRIDINE DERIVATIVE PIM KINASE INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN MEDICINE PREPARATION 上海吉铠医药科技有限公司 2017-03-23 — — WO disclosed
WO-2017045612-A1 PYRIMIDINE DERIVATIVE PIM KINASE INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN MEDICINE PREPARATION 上海吉铠医药科技有限公司 2017-03-23 — — WO disclosed
WO-2017045616-A1 ISOTHIAZOLE DERIVATIVE PIM KINASE INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN MEDICINE PREPARATION 上海吉铠医药科技有限公司 2017-03-23 — — WO disclosed
CN-106243018-A A kind of synthetic method of poly-fluorine phenyl pyridine compounds and their 陕西师范大学 2016-12-21 — — CN disclosed
US-20150315150-A1 KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2015-11-05 — — US disclosed
US-20150315150-A1 KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2015-11-05 — — US disclosed
US-20120134987-A1 KINASE INHIBITORS AND METHODS OF THEIR USE BURGER MATTHEW T (US) 2012-05-31 — — US disclosed
US-20120134987-A1 KINASE INHIBITORS AND METHODS OF THEIR USE BURGER MATTHEW T (US) 2012-05-31 — — US disclosed
US-20120134987-A1 KINASE INHIBITORS AND METHODS OF THEIR USE BURGER MATTHEW T (US) 2012-05-31 — — US disclosed
WO-2012004217-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-12 — — WO disclosed
WO-2012004217-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-12 — — WO disclosed
EP-2344474-A1 PICOLINAMIDE DERIVATIVES AS KINASE INHIBITORS Novartis AG (CH) 2011-07-20 — — EP disclosed
WO-2010026124-A1 PICOLINAMIDE DERIVATIVES AS KINASE INHIBITORS NOVARTIS AG (CH) 2010-03-11 — — WO disclosed
US-20100056576-A1 Kinase inhibitors and methods of their use NOVARTIS AG (CH) 2010-03-04 — — US disclosed
US-20100056576-A1 Kinase inhibitors and methods of their use NOVARTIS AG (CH) 2010-03-04 — — US disclosed
US-20100056576-A1 Kinase inhibitors and methods of their use NOVARTIS AG (CH) 2010-03-04 — — US 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 (3 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-20120134987-A1 KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 CCR1 2733/4885CCR8 2917/4885L3MBTL1 750/4885
US-20100056576-A1 Kinase inhibitors and methods of their use PIM1, PIM2, PIM3 CCR1 2733/4885CCR8 2917/4885L3MBTL1 750/4885
US-20150315150-A1 KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 CCR1 2733/4885CCR8 2917/4885L3MBTL1 750/4885

“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