SCHEMBL296554

SCHEMBL296554

C1=C(C2=CCCCC2)CCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYMP P19971 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
ACMSD Q8TDX5 1/20 0.39
KDM1A O60341 1/20 0.39
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
JAK3 P52333 1/20 0.38
PSMB5 P28074 4/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
PTGS2 P35354 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
PSMB1 P20618 1/20 0.36

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
SCHEMBL119773 0.97 TYMP (0.41) TYMPTDP1ALDH1A1CYP3A4ACMSD
SCHEMBL11201526 0.97 TYMP (0.41) TYMPTDP1ALDH1A1CYP3A4ACMSD
SCHEMBL18244172 0.97 TYMP (0.41) TYMPTDP1ALDH1A1CYP3A4ACMSD
SCHEMBL3233355 0.97 TYMP (0.41) TYMPTDP1ALDH1A1CYP3A4ACMSD
SCHEMBL2105114 0.97 TYMP (0.41) TYMPTDP1ALDH1A1CYP3A4ACMSD
SCHEMBL3233362 0.97 TYMP (0.41) TYMPTDP1ALDH1A1CYP3A4ACMSD
SCHEMBL18244171 0.97 TYMP (0.41) TYMPTDP1ALDH1A1CYP3A4ACMSD
SCHEMBL3502363 0.97 TYMP (0.41) TYMPTDP1ALDH1A1CYP3A4ACMSD
SCHEMBL21057468 0.97 TYMP (0.41) TYMPTDP1ALDH1A1CYP3A4ACMSD
SCHEMBL3796623 0.97 TYMP (0.41) TYMPTDP1ALDH1A1CYP3A4ACMSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6432995-B1 None US claimed
US-20260035384-A1 COMPOUND CONTAINING CYCLOHEXYL CHIA TAI TIANQING PHARMACEUTICAL GROUP CO LTD (CN) 2026-02-05 US claimed
CN-120192323-A Pyrrolidone-containing compounds 正大天晴药业集团股份有限公司 2025-06-24 CN claimed
US-20250152719-A1 FUSED IMIDE DERIVATIVE CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2025-05-15 US claimed
CN-119823111-A Condensed imide derivative 正大天晴药业集团股份有限公司 2025-04-15 CN claimed
CN-119731182-A Cyclohexyl containing compounds 正大天晴药业集团股份有限公司 2025-03-28 CN claimed
WO-2025040147-A1 CYCLOBUTYL-CONTAINING COMPOUNDS 正大天晴药业集团股份有限公司 2025-02-27 WO claimed
CN-119462663-A Pyrrolidone-containing compounds 正大天晴药业集团股份有限公司 2025-02-18 CN claimed
CN-118994163-A Compounds containing a fused ring structure 正大天晴药业集团股份有限公司 2024-11-22 CN claimed
CN-116285709-B Low-stress bonding adhesive material and preparation method thereof 黑龙江省科学院石油化学研究院 2024-11-22 CN claimed
WO-2001004115-A2 NOVEL PROCESS FOR SYNTHESIS OF HETEROARYL-SUBSTITUTED UREA COMPOUNDS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2001-01-18 WO claimed
WO-2000055139-A2 HETEROCYCLIC UREA AND RELATED COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2000-09-21 WO claimed
WO-2000055152-A1 AROMATIC HETEROCYCLIC COMPOUNDS AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2000-09-21 WO claimed
WO-2000050425-A1 POLYCYCLO HETEROCYCLIC DERIVATIVES AS ANTIINFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2000-08-31 WO claimed
EP-1028953-A1 AROMATIC HETEROCYCLIC COMPOUNDS AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2000-08-23 EP claimed
WO-2000043384-A1 AROMATIC HETEROCYCLIC COMPOUNDS AS ANTIINFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2000-07-27 WO claimed
US-6080763-A INHIBIT THE RELEASE OF INFLAMMATORY CYTOKINES, E.G., TUMOR NECROSIS FACTOR AND INTERLEUKIN-1; USEFUL TO TREAT CHRONIC INFLAMMATORY DISEASE; AUTOIMMUNE DISEASES, E.G. RHEUMATOID ARTHRITIS, OSTEOPOROSIS; PYRAZOLYLUREAS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2000-06-27 US claimed
WO-1999023091-A1 AROMATIC HETEROCYCLIC COMPOUNDS AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 1999-05-14 WO claimed
WO-1994012029-A1 USE OF FUSED RING CYCLOPENTANONES AND CYCLOPENTENONES IN CONTROLLING PLANT GROWTH BRITISH TECHNOLOGY GROUP LIMITED (GB) 1994-06-09 WO claimed
US-4247711-A CHEMICAL INTERMEDIATES FOR PYRETHRUM PESTICIDES SHELL OIL COMPANY (US) 1981-01-27 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20260035384-A1 COMPOUND CONTAINING CYCLOHEXYL CYP11B1, CYP4A11, CYP11B2 TYMP 2718/4885TDP1 4504/4885ALDH1A1 344/4885
US-20250152719-A1 FUSED IMIDE DERIVATIVE WEE1, WEE2, CYP4F11 TYMP 496/4885TDP1 2817/4885ALDH1A1 634/4885

“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.