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Sugi Predict / Compounds / SCHEMBL2912995

SCHEMBL2912995

SCHEMBL2912995

Cc1c(C)c2c(c(C)c1NC(=O)c1ccc(Cl)cc1)C(c1ccc(C(C)C)cc1)C(C)(C)O2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.39
▸ RAB9A P51151 4/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ DEGS1 O15121 1/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ KDM4E B2RXH2 4/20 0.36
▸ LMNA P02545 3/20 0.36
▸ HTT P42858 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TP53 P04637 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ NFKB1 P19838 1/20 0.34
▸ NFKB2 Q00653 1/20 0.34
▸ RELA Q04206 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
SCHEMBL2905201 0.92 LMNA (0.36) SMN1; SMN2RAB9AKMT2ADEGS1KDM4E
SCHEMBL2905197 0.91 KDM4E (0.35) RAB9AMEN1KMT2ADEGS1CYP2C19
SCHEMBL2911427 0.91 LMNA (0.40) SMN1; SMN2RAB9AKMT2ADEGS1CYP2C19
SCHEMBL2909184 0.90 RAB9A (0.41) SMN1; SMN2RAB9ADEGS1KDM4ELMNA
SCHEMBL2913347 0.89 RAB9A (0.42) SMN1; SMN2RAB9AMEN1KMT2ACYP2C19
SCHEMBL2905121 0.89 RAB9A (0.37) SMN1; SMN2RAB9AKMT2ADEGS1KDM4E
Hydrochloric Acid SCHEMBL2942902 0.88 ROCK2 (0.37) SMN1; SMN2RAB9AKMT2ADEGS1KDM4E
SCHEMBL4092709 0.86 TP53 (0.31) SMN1; SMN2RAB9AKMT2ALMNAALDH1A1
SCHEMBL2910674 0.85 PKM (0.43) SMN1; SMN2RAB9AMEN1KMT2AKDM4E
SCHEMBL2943035 0.84 MEN1 (0.43) SMN1; SMN2RAB9AMEN1KMT2AALDH1A1

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
EP-1481679-B1 ANTIDEPRESSANT TAKEDA PHARMACEUTICAL (JP) 2010-08-25 — — EP disclosed
US-7750037-B2 Antidepressant TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-07-06 — — US disclosed
EP-2059563-A2 FLUORO-SUBSTITUTED BENZOXAZOLE POLYMETHINE DYES GE Healthcare UK Limited (GB) 2009-05-20 — — EP disclosed
EP-1323716-B1 PROMOTERS FOR THE PROLIFERATION AND DIFFERENTIATION OF STEM CELLS AND/OR NEURON PRECURSOR CELLS TAKEDA PHARMACEUTICAL (JP) 2009-01-14 — — EP disclosed
US-20090012081-A1 Agents for promoting the proliferation or differentiation of stem cells or neural progenitor cells TAKEDA PHARMACEUTICAL COMPANY LTD. (JP) 2009-01-08 — — US disclosed
US-7456162-B2 Benzofuran derivatives, their production and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-25 — — US disclosed
WO-2008040994-A2 FLUORO-SUBSTITUTED BENZOXAZOLE POLYMETHINE DYES GE HEALTHCARE UK LIMITED (GB) 2008-04-10 — — WO disclosed
US-20060241168-A1 Antidepressant OHKAWA SHIGENORI 2006-10-26 — — US disclosed
US-7101867-B2 Benzofuran derivatives, their production and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-09-05 — — US disclosed
US-20050187238-A1 Benzofuran derivatives, their production and use OHKAWA SHIGENORI (JP) 2005-08-25 — — US disclosed
US-20050148650-A1 Antidepressant TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-07-07 — — US disclosed
EP-1481679-A1 ANTIDEPRESSANT Takeda Chemical Industries, Ltd. (JP) 2004-12-01 — — EP disclosed
EP-1136477-B1 BENZOFURAN DERIVATIVES, PROCESS FOR THE PREPARATION OF THE SAME AND USES THEREOF TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-03-10 — — EP disclosed
US-20040034049-A1 Promoters for the proliferation and differentiation of stem cells and/or neuron precursor cells TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-02-19 — — US disclosed
EP-1323716-A1 PROMOTERS FOR THE PROLIFERATION AND DIFFERENTIATION OF STEM CELLS AND/OR NEURON PRECURSOR CELLS Takeda Chemical Industries, Ltd. (JP) 2003-07-02 — — EP disclosed
US-6479536-B1 Benzofuran derivatives, process for the preparation of the same and uses thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-11-12 — — US disclosed
US-20020160996-A1 Benzofuran derivatives, their production and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2002-10-31 — — US disclosed
EP-1136477-A1 BENZOFURAN DERIVATIVES, PROCESS FOR THE PREPARATION OF THE SAME AND USES THEREOF Takeda Chemical Industries, Ltd. (JP) 2001-09-26 — — 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 (6 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-20050148650-A1 Antidepressant AKT1S1, AKT1, AKT2 SMN1; SMN2 3766/4885RAB9A 1372/4885MEN1 2613/4885
US-20060241168-A1 Antidepressant AKT1S1, AKT1, AKT2 SMN1; SMN2 3766/4885RAB9A 1372/4885MEN1 2613/4885
US-20090012081-A1 Agents for promoting the proliferation or differentiation of stem cells or neural progenitor cells NES, MKI67, CCNO SMN1; SMN2 376/4885RAB9A 2438/4885MEN1 2906/4885
US-20050187238-A1 Benzofuran derivatives, their production and use WDR1, WDR82, CBR1 SMN1; SMN2 54/4885RAB9A 2549/4885MEN1 2912/4885
US-20040034049-A1 Promoters for the proliferation and differentiation of stem cells and/or neuron precursor cells NES, HAT1, PROX1 SMN1; SMN2 528/4885RAB9A 2371/4885MEN1 3718/4885
US-20020160996-A1 Benzofuran derivatives, their production and use PARK7, WDR1, WHR1 SMN1; SMN2 16/4885RAB9A 2580/4885MEN1 3777/4885

“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.