SCHEMBL4589649

SCHEMBL4589649

Fc1ccc(-c2nccs2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.63
LOXL2 Q9Y4K0 1/20 0.60
ADRB2 P07550 2/20 0.55
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
KMT2A Q03164 2/20 0.50
CYP2A6 P11509 1/20 0.50
PKM P14618 1/20 0.50
SYK P43405 1/20 0.49
CYP1A1 P04798 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP1B1 Q16678 1/20 0.49
FBP1 P09467 1/20 0.47
MAPK14 Q16539 1/20 0.46
KDM4E B2RXH2 1/20 0.46
AR P10275 1/20 0.46
ALDH1A1 P00352 2/20 0.45
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NFKB1 P19838 1/20 0.45

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
SCHEMBL722198 0.89 PDPK1 (0.77) PDPK1LOXL2ADRB2RAB9ACYP2A6
SCHEMBL28033488 0.85 PDPK1 (0.56) PDPK1LOXL2ADRB2NPC1RAB9A
SCHEMBL17704291 0.80 PDPK1 (0.65) PDPK1LOXL2ADRB2RAB9ACYP2A6
SCHEMBL19219079 0.78 PDPK1 (0.63) PDPK1LOXL2ADRB2NPC1RAB9A
SCHEMBL21791658 0.78 LOXL2 (0.71) PDPK1LOXL2ADRB2CYP2A6ABL1
SCHEMBL3885226 0.78 LOXL2 (0.66) PDPK1LOXL2ADRB2NPC1RAB9A
SCHEMBL5147639 0.78 PDPK1 (0.91) PDPK1LOXL2ADRB2RAB9ACYP2A6
SCHEMBL466426 0.78 PDPK1 (0.63) PDPK1LOXL2ADRB2CYP2A6SYK
SCHEMBL16119908 0.78 PDPK1 (0.63) PDPK1LOXL2ADRB2RAB9ACYP2A6
SCHEMBL10576999 0.78 PDPK1 (0.63) PDPK1LOXL2ADRB2RAB9ACYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110372630-A The diphenyl ethylene analogue and its synthetic method of a kind of structure containing phenyl thiazole and application 浙江工业大学 2019-10-25 CN claimed
CN-105339370-B Compound and and its pharmaceutical composition for treating diseases associated with inflammation 加拉帕戈斯股份有限公司 2017-09-15 CN claimed
CN-87103235-A The photosensitive azole pesticides 1988-06-08 CN claimed
EP-4722208-A1 NOVEL BENZAMIDE DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Samjin Pharmaceutical Co., Ltd. (KR) 2026-04-08 EP disclosed
US-12527776-B2 Treatment of ciliopathies using inhibitors of glucosylceramide synthase (GCS) GENZYME CORPORATION (US) 2026-01-20 US disclosed
US-20250388536-A1 3-ALKYNYL CARBOXAMIDES AS AEP MODULATORS HOFFMANN-LA ROCHE INC. (US) 2025-12-25 US disclosed
US-20250376452-A1 17-Beta-Hydroxysteroid Dehydrogenase Type 13 Inhibitors and Methods of Use Thereof ENANTA PHARM INC (US) 2025-12-11 US disclosed
US-12384753-B2 17-beta-hydroxysteroid dehydrogenase type 13 inhibitors and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2025-08-12 US disclosed
US-20250179008-A1 ANTIBACTERIAL AGENTS TAXIS PHARMACEUTICALS, INC. (US) 2025-06-05 US disclosed
EP-4486444-A1 3-ALKYNYL CARBOXAMIDES AS AEP MODULATORS F. Hoffmann-La Roche AG (CH) 2025-01-08 EP disclosed
WO-2024246764-A1 NOVEL BENZAMIDE DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 삼진제약주식회사 2024-12-05 WO disclosed
WO-2014110705-A1 HETEROCYCLE-SUBSTITUED TETRACYCLIC COMPOUNDS AND METHODS OF USE THEREOF FOR TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME CORP. (US) 2014-07-24 WO disclosed
US-20130085148-A1 Pyridine Derivatives ENDO PHARMACEUTICALS INC. (US) 2013-04-04 US disclosed
WO-2013049559-A1 PYRIDINE DERIVATIVES ENDO PHARMACEUTICALS INC. (US) 2013-04-04 WO disclosed
WO-2013049559-A1 PYRIDINE DERIVATIVES ENDO PHARMACEUTICALS INC. (US) 2013-04-04 WO disclosed
US-20130085148-A1 Pyridine Derivatives ENDO PHARMACEUTICALS INC. (US) 2013-04-04 US disclosed
US-20130085148-A1 Pyridine Derivatives ENDO PHARMACEUTICALS INC. (US) 2013-04-04 US disclosed
US-20080051415-A1 Novel piperazines, pharmaceutical compositions and methods of use thereof THE FEINSTEIN INSTITUTES FOR MEDICAL RESEARCH 2008-02-28 US disclosed
US-4766213-A 1,4-dihydropyridines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-08-23 US disclosed
CN-87103235-A The photosensitive azole pesticides 1988-06-08 CN 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 (7 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-20130085148-A1 Pyridine Derivatives CYP2A7, CYP21A2, CYP3A7 PDPK1 1403/4885LOXL2 3364/4885ADRB2 3232/4885
US-12527776-B2 Treatment of ciliopathies using inhibitors of glucosylceramide synthase (GCS) GBA1, GBA2, GALC PDPK1 1231/4885LOXL2 565/4885ADRB2 1595/4885
US-20250376452-A1 17-Beta-Hydroxysteroid Dehydrogenase Type 13 Inhibitors and Methods of Use Thereof HSD17B1, HSD17B13, HSD17B3 PDPK1 1217/4885LOXL2 3518/4885ADRB2 1717/4885
US-20250388536-A1 3-ALKYNYL CARBOXAMIDES AS AEP MODULATORS CNR2, CNR1, FAAH2 PDPK1 1261/4885LOXL2 1649/4885ADRB2 19/4885
US-12384753-B2 17-beta-hydroxysteroid dehydrogenase type 13 inhibitors and methods of use thereof HSD17B1, HSD17B13, HSD17B3 PDPK1 1217/4885LOXL2 3518/4885ADRB2 1717/4885
US-20250179008-A1 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 PDPK1 4423/4885LOXL2 1520/4885ADRB2 880/4885
US-20080051415-A1 Novel piperazines, pharmaceutical compositions and methods of use thereof CHRNA7, CHRNA5, CHRNA2 PDPK1 1326/4885LOXL2 2580/4885ADRB2 111/4885

“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.