SCHEMBL1417152

SCHEMBL1417152

CC(C)COc1cc(Br)cc(Br)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
SOD1 P00441 1/20 0.39
ALDH1A1 P00352 4/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 4/20 0.36
POLB P06746 2/20 0.36
XBP1 P17861 1/20 0.36
PLA2G7 Q13093 1/20 0.35
KDM4E B2RXH2 2/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
SMPD1 P17405 1/20 0.35
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
RAB9A P51151 1/20 0.34
HSD17B10 Q99714 1/20 0.34
S1PR1 P21453 1/20 0.34
PDK2 Q15119 1/20 0.33
ABL1 P00519 1/20 0.33

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
SCHEMBL18951697 0.86 FFAR4 (0.40) MAPTALDH1A1GAAHPGDPOLB
SCHEMBL16953934 0.86 MAPT (0.36) MAPTSOD1ALDH1A1GAAHPGD
SCHEMBL1417094 0.86 MAPT (0.34) MAPTSOD1ALDH1A1GAAHPGD
Water SCHEMBL27733080 0.85 MAPT (0.35) MAPTSOD1ALDH1A1GAAHPGD
Water SCHEMBL27733081 0.85 MAPT (0.35) MAPTSOD1ALDH1A1GAAHPGD
SCHEMBL24156965 0.83 MAPT (0.35) MAPTALDH1A1GAAHPGDPOLB
SCHEMBL16952753 0.83 MAPT (0.36) MAPTALDH1A1HPGDPOLBXBP1
SCHEMBL18304384 0.82 MAOA (0.38) MAPTSOD1ALDH1A1PLA2G7SMPD1
SCHEMBL16961433 0.82 MAPT (0.34) MAPTALDH1A1GAAHPGDPOLB
SCHEMBL16956981 0.82 MAPT (0.36) MAPTALDH1A1GAAHPGDPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021259208-A1 TYK-2 INHIBITOR BEIGENE, LTD. (KY) 2021-12-30 WO disclosed
US-20200115339-A1 EFFLUX-PUMP INHIBITORS AND THERAPEUTIC USES THEREOF Basilea Pharmaceutica International AG (CH) 2020-04-16 US disclosed
US-10464896-B2 Efflux-pump inhibitors and therapeutic uses thereof Basilea Pharmaceutica International AG (CH) 2019-11-05 US disclosed
US-20180179158-A1 EFFLUX-PUMP INHIBITORS AND THERAPEUTIC USES THEREOF Basilea Pharmaceutica International AG (CH) 2018-06-28 US disclosed
EP-3307725-A1 EFFLUX-PUMP INHIBITORS AND THERAPEUTIC USES THEREOF Basilea Pharmaceutica International AG (CH) 2018-04-18 EP disclosed
WO-2016198691-A1 EFFLUX-PUMP INHIBITORS AND THERAPEUTIC USES THEREOF BASILEA PHARMACEUTICA AG (CH) 2016-12-15 WO disclosed
US-8426473-B2 Phenoxy acetic acids as PPAR delta activators High Point Pharnaceuticals, LLC (US) 2013-04-23 US disclosed
US-20120232080-A1 PHENOXY ACETIC ACIDS AS PPAR DELTA ACTIVATORS HIGH POINT PHARMACEUTICALS, LLC (US) 2012-09-13 US disclosed
US-8217086-B2 Phenoxy acetic acids as PPAR delta activators HIGH POINT PHARMACEUTICALS, LLC (US) 2012-07-10 US disclosed
EP-1899302-B1 PHENOXY ACETIC ACIDS AS PPAR DELTA ACTIVATORS HIGH POINT PHARMACEUTICALS LLC (US) 2011-10-19 EP disclosed
US-20110183982-A1 PHENOXY ACETIC ACIDS AS PPAR DELTA ACTIVATORS HIGH POINT PHARMACEUTICALS, LLC (US) 2011-07-28 US disclosed
US-7943669-B2 Phenoxy acetic acids as PPAR delta activators HIGH POINT PHARMACEUTICALS, LLC (US) 2011-05-17 US disclosed
EP-2298742-A1 Phenoxy acetic acids as PPAR delta activators High Point Pharmaceuticals, LLC (US) 2011-03-23 EP disclosed
US-20090192162-A1 Phenoxy Acetic Acids as PPAR Delta Activators TRANSTECH PHARMA, INC. (NC) 2009-07-30 US disclosed
EP-1899302-A1 PHENOXY ACETIC ACIDS AS PPAR DELTA ACTIVATORS Novo Nordisk A/S (DK) 2008-03-19 EP disclosed
WO-2007003581-A1 PHENOXY ACETIC ACIDS AS PPAR DELTA ACTIVATORS NOVO NORDISK A/S (DK) 2007-01-11 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 (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-20090192162-A1 Phenoxy Acetic Acids as PPAR Delta Activators PPARA, PPARG, PPARD MAPT 2797/4885SOD1 3649/4885ALDH1A1 159/4885
US-20200115339-A1 EFFLUX-PUMP INHIBITORS AND THERAPEUTIC USES THEREOF ABCB11, ABCC1, ABCC3 MAPT 3746/4885SOD1 1061/4885ALDH1A1 347/4885
US-20120232080-A1 PHENOXY ACETIC ACIDS AS PPAR DELTA ACTIVATORS PPARA, PPARG, PPARD MAPT 2797/4885SOD1 3649/4885ALDH1A1 159/4885
US-10464896-B2 Efflux-pump inhibitors and therapeutic uses thereof ABCB11, ABCC1, ABCC3 MAPT 3744/4885SOD1 1126/4885ALDH1A1 349/4885
US-20110183982-A1 PHENOXY ACETIC ACIDS AS PPAR DELTA ACTIVATORS PPARA, PPARG, PPARD MAPT 2797/4885SOD1 3649/4885ALDH1A1 159/4885
US-20180179158-A1 EFFLUX-PUMP INHIBITORS AND THERAPEUTIC USES THEREOF ABCB11, ABCC1, ABCC3 MAPT 3744/4885SOD1 1126/4885ALDH1A1 349/4885

“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.