SCHEMBL17135804

SCHEMBL17135804

CC1=CC(c2ccc(F)cc2)=CC1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.37
NFE2L2 Q16236 1/20 0.34
PTGS1 P23219 4/20 0.32
PTGS2 P35354 3/20 0.32
LMNA P02545 1/20 0.30
THRB P10828 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL17147179 0.79 CYP1A2 (0.34) PTGS2LMNANPC1RAB9A
SCHEMBL17135799 0.79 KIF11 (0.41) PTGS1PTGS2LMNATHRB
SCHEMBL7635776 0.78 ALDH1A1 (0.35) ACHELMNA
SCHEMBL1824459 0.78 ALDH1A1 (0.35) ACHELMNA
SCHEMBL24385477 0.73 CYP2A6 (0.41)
SCHEMBL17135818 0.66 HTR2C (0.43) NPC1RAB9A
SCHEMBL13221422 0.64 MAPK14 (0.41) ACHEPTGS1PTGS2LMNATHRB
SCHEMBL17147180 0.63 ALDH1A1 (0.34)
SCHEMBL197346 0.61 BCL2L1 (0.55) ACHENPC1RAB9A
SCHEMBL10337645 0.61 BCL2L1 (0.55) ACHENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9701771-B2 Substituted zirconocenes catalysts and methods of use in polymerization reactions BASELL POLYOLEFINE GMBH (DE) 2017-07-11 US disclosed
US-9701771-B2 Substituted zirconocenes catalysts and methods of use in polymerization reactions BASELL POLYOLEFINE GMBH (DE) 2017-07-11 US disclosed
US-9701771-B2 Substituted zirconocenes catalysts and methods of use in polymerization reactions BASELL POLYOLEFINE GMBH (DE) 2017-07-11 US disclosed
US-9422380-B2 Non-bridged metallocene complexes for the polymerization of olefins Basell Polyolefine Wesseling (DE) 2016-08-23 US disclosed
US-9422380-B2 Non-bridged metallocene complexes for the polymerization of olefins Basell Polyolefine Wesseling (DE) 2016-08-23 US disclosed
US-9422380-B2 Non-bridged metallocene complexes for the polymerization of olefins Basell Polyolefine Wesseling (DE) 2016-08-23 US disclosed
US-9422319-B2 Bisaryl metallocenes and use thereof to produce polyolefins BASELL POLYOLEFINE GMBH (DE) 2016-08-23 US disclosed
US-9422319-B2 Bisaryl metallocenes and use thereof to produce polyolefins BASELL POLYOLEFINE GMBH (DE) 2016-08-23 US disclosed
US-9422319-B2 Bisaryl metallocenes and use thereof to produce polyolefins BASELL POLYOLEFINE GMBH (DE) 2016-08-23 US disclosed
US-20150284490-A1 SUBSTITUTED ZIRCONOCENES CATALYSTS AND METHODS OF USE IN POLYMERIZATION REACTIONS BASELL POLYOLEFIN GMBH (DE) 2015-10-08 US disclosed
US-20150284490-A1 SUBSTITUTED ZIRCONOCENES CATALYSTS AND METHODS OF USE IN POLYMERIZATION REACTIONS BASELL POLYOLEFIN GMBH (DE) 2015-10-08 US disclosed
US-20150284489-A1 NON-BRIDGED METALLOCENE COMPLEXES FOR THE POLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2015-10-08 US disclosed
US-20150284489-A1 NON-BRIDGED METALLOCENE COMPLEXES FOR THE POLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2015-10-08 US disclosed
US-20150284490-A1 SUBSTITUTED ZIRCONOCENES CATALYSTS AND METHODS OF USE IN POLYMERIZATION REACTIONS BASELL POLYOLEFIN GMBH (DE) 2015-10-08 US disclosed
US-20150284418-A1 BISARYL METALLOCENES AND USE THEREOF TO PRODUCE POLYOLEFINS BASELL POLYOLEFIN GMBH (DE) 2015-10-08 US disclosed
US-20150284418-A1 BISARYL METALLOCENES AND USE THEREOF TO PRODUCE POLYOLEFINS BASELL POLYOLEFIN GMBH (DE) 2015-10-08 US disclosed
US-20150284489-A1 NON-BRIDGED METALLOCENE COMPLEXES FOR THE POLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2015-10-08 US disclosed
US-20150284418-A1 BISARYL METALLOCENES AND USE THEREOF TO PRODUCE POLYOLEFINS BASELL POLYOLEFIN GMBH (DE) 2015-10-08 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-20150284418-A1 BISARYL METALLOCENES AND USE THEREOF TO PRODUCE POLYOLEFINS PCBP1, PARG, PARN ACHE 1371/4885NFE2L2 1150/4885PTGS1 3548/4885
US-20150284490-A1 SUBSTITUTED ZIRCONOCENES CATALYSTS AND METHODS OF USE IN POLYMERIZATION REACTIONS MAOA, MPO, PARP1 ACHE 327/4885NFE2L2 1463/4885PTGS1 2569/4885
US-20150284489-A1 NON-BRIDGED METALLOCENE COMPLEXES FOR THE POLYMERIZATION OF OLEFINS PCBP1, MORF4L1, PPIL4 ACHE 3794/4885NFE2L2 272/4885PTGS1 2480/4885

“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.