Sugi Predict

Sugi Predict / Compounds / SCHEMBL7779187

SCHEMBL7779187

SCHEMBL7779187

CC(=O)c1ccc(Cl)cc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ TP53 P04637 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ TMPRSS4 Q9NRS4 7/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ CES2 O00748 1/20 0.46
▸ GRIK1 P39086 1/20 0.44
▸ P2RX1 P51575 1/20 0.44
▸ P2RX4 Q99571 1/20 0.44
▸ P2RX7 Q99572 1/20 0.44
▸ POLQ O75417 1/20 0.43
▸ FLT1 P17948 1/20 0.43
▸ FLT4 P35916 1/20 0.43
▸ KDR P35968 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ CA12 O43570 1/20 0.41

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
SCHEMBL31591114 1.00 RAB9A (0.50) RAB9ASMN1; SMN2TP53MAPTTMPRSS4
SCHEMBL427243 0.85 SMN1; SMN2 (0.59) RAB9ASMN1; SMN2TP53MAPTCYP1A2
SCHEMBL28462798 0.85 RAB9A (0.50) RAB9ASMN1; SMN2TP53MAPTTMPRSS4
SCHEMBL110827 0.83 RAB9A (0.49) RAB9ASMN1; SMN2TP53MAPTTMPRSS4
SCHEMBL10256214 0.83 NR1H4 (0.49) RAB9ASMN1; SMN2TP53MAPTKDM4E
SCHEMBL14645660 0.82 AR (0.54) MAPTFLT1FLT4KDRMAOB
SCHEMBL29741809 0.82 AR (0.54) MAPTFLT1FLT4KDRMAOB
SCHEMBL26023312 0.82 RAB9A (0.48) RAB9ASMN1; SMN2TP53MAPTTMPRSS4
SCHEMBL8491232 0.82 RAB9A (0.48) RAB9ASMN1; SMN2TP53MAPTTMPRSS4
SCHEMBL31591119 0.81 TMPRSS4 (0.41) RAB9ASMN1; SMN2TP53MAPTTMPRSS4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113968775-A Intermediate compound for preparing 4-chloro-2-trifluoromethyl-acetophenone, preparation method and application thereof 江苏丰山集团股份有限公司 2022-01-25 — — CN claimed
CN-114573432-A Method for preparing 4-halo-2-trifluoromethylacetophenone 帕潘纳(北京)科技有限公司 2022-06-03 — — CN disclosed
CN-113968775-A Intermediate compound for preparing 4-chloro-2-trifluoromethyl-acetophenone, preparation method and application thereof 江苏丰山集团股份有限公司 2022-01-25 — — CN disclosed
CN-113968775-A Intermediate compound for preparing 4-chloro-2-trifluoromethyl-acetophenone, preparation method and application thereof 江苏丰山集团股份有限公司 2022-01-25 — — CN disclosed
CN-113968775-A Intermediate compound for preparing 4-chloro-2-trifluoromethyl-acetophenone, preparation method and application thereof 江苏丰山集团股份有限公司 2022-01-25 — — CN disclosed
WO-2020132792-A1 2-BENZOYL MALONATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 江苏联化科技有限公司 2020-07-02 — — WO disclosed
WO-2020132792-A1 2-BENZOYL MALONATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 江苏联化科技有限公司 2020-07-02 — — WO disclosed
CN-111348996-A 2-benzoyl malonate compound, preparation method and application thereof 江苏联化科技有限公司 2020-06-30 — — CN disclosed
WO-2020020816-A1 NOVEL TRIAZOLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2020-01-30 — — WO disclosed
EP-3083540-B1 PROCESS FOR THE PREPARATION OF SUBSTITUTED PHENOXYPHENYL KETONES BASF AGRO BV (NL) 2019-11-20 — — EP disclosed
US-20160318881-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED PHENOXYPHENYL KETONES BASF Agro B.V. (NL) 2016-11-03 — — US disclosed
EP-3083540-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED PHENOXYPHENYL KETONES BASF Agro B.V. (NL) 2016-10-26 — — EP disclosed
CN-105829274-A Process for the Preparation of Substituted Phenoxyphenyl Ketones 巴斯夫农业公司 2016-08-03 — — CN disclosed
WO-2015091045-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED PHENOXYPHENYL KETONES BASF Agro B.V. (NL) 2015-06-25 — — WO disclosed
EP-0735142-B1 Process for producing (R)-styrene oxides SUMIKA FINE CHEMICALS CO LTD (JP) 2001-10-24 — — EP disclosed
US-5717116-A TREATING A MIXTURE OF PHENYLHALOGENOMETHYLCARBINOLS WITH A LIPASE IN THE PRESENCE OF A CARBOXYLATE FOLLOWED BY CYCLIZATION WITH A BASE SUMIKA FINE CHEMICALS COMPANY, LIMITED (JP) 1998-02-10 — — US disclosed
EP-0735142-A2 Process for producing (R)-styrene oxides SUMIKA FINE CHEMICAL COMPANY, LTD. (JP) 1996-10-02 — — EP disclosed
CN-1064481-A Hydrazone compound, its preparation method reach the pesticide composition that it is prepared useful intermediate and contains these materials ISHIHARA SANGYO KAISHA (JP) 1992-09-16 — — CN disclosed
EP-0080071-B1 2-IMIDAZOLYLMETHYL-2-PHENYL-1,3-DIOXOLANES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS FUNGICIDES BAYER AG (DE) 1987-05-13 — — EP disclosed
EP-0080071-A2 2-Imidazolylmethyl-2-phenyl-1,3-dioxolanes, process for their preparation and their use as fungicides BAYER AG (DE) 1983-06-01 — — 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 (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-20160318881-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED PHENOXYPHENYL KETONES CYP3A4, CYP3A43, CYP2E1 RAB9A 3905/4885SMN1; SMN2 4325/4885TP53 3461/4885

“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.