SCHEMBL55100

SCHEMBL55100

CC(C)(C)C1CCC(N)CC1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.35
LIPA P38571 1/20 0.33
APOBEC3A P31941 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GLA P06280 1/20 0.31
EPHX2 P34913 1/20 0.31
HSD11B1 P28845 1/20 0.31
CYP19A1 P11511 1/20 0.30

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
SCHEMBL1765188 1.00 EPHX1 (0.35) EPHX1LIPAAPOBEC3AAPOBEC3GKDM4E
SCHEMBL3108061 1.00 EPHX1 (0.35) EPHX1LIPAAPOBEC3AAPOBEC3GKDM4E
Hydrochloric Acid SCHEMBL1241006 0.97 EPHX1 (0.34) EPHX1LIPAAPOBEC3AAPOBEC3GKDM4E
Hydrochloric Acid SCHEMBL1241009 0.97 EPHX1 (0.34) EPHX1LIPAAPOBEC3AAPOBEC3GKDM4E
SCHEMBL8695427 0.89 EPHX1 (0.35) EPHX1APOBEC3AAPOBEC3GKDM4EHTT
SCHEMBL28461608 0.89 EPHX1 (0.31) EPHX1
SCHEMBL13171471 0.85 LIPA (0.39) LIPAAPOBEC3AAPOBEC3G
SCHEMBL521457 0.83 EPHX1 (0.40) EPHX1LIPAAPOBEC3AAPOBEC3GKDM4E
SCHEMBL5615220 0.83 EPHX1 (0.42) EPHX1LIPAAPOBEC3AAPOBEC3GKDM4E
SCHEMBL22797 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12559453-B2 Sulfonic acid-modified polyisocyanate and preparation method therefor WANHUA CHEMICAL GROUP CO., LTD. (CN) 2026-02-24 US claimed
EP-4144780-B1 SULFONIC ACID-MODIFIED POLYISOCYANATE AND PREPARATION METHOD THEREFOR WANHUA CHEMICAL GROUP CO LTD (CN) 2025-12-24 EP claimed
WO-2025089950-A1 PROCESS FOR REMOVING CO2 FROM GAS CARBONORO TECHNOLOGY B.V. (NL) 2025-05-01 WO claimed
CN-115466201-B Sulfonic acid modified polyisocyanate and preparation method thereof 万华化学集团股份有限公司 2024-05-03 CN claimed
CN-114713007-B CO in flue gas is removed 2 Is a composite decarbonization solution, apparatus and method 中国天辰工程有限公司 2023-11-24 CN claimed
US-20230257344-A1 SULFONIC ACID-MODIFIED POLYISOCYANATE AND PREPARATION METHOD THEREFOR WANHUA CHEMICAL GROUP CO., LTD. (CN) 2023-08-17 US claimed
EP-4144780-A1 SULFONIC ACID-MODIFIED POLYISOCYANATE AND PREPARATION METHOD THEREFOR Wanhua Chemical Group Co., Ltd. (CN) 2023-03-08 EP claimed
WO-2022257585-A1 SULFONIC ACID-MODIFIED POLYISOCYANATE AND PREPARATION METHOD THEREFOR 万华化学集团股份有限公司 2022-12-15 WO claimed
CN-115466201-A Sulfonic acid modified polyisocyanate and preparation method thereof 万华化学集团股份有限公司 2022-12-13 CN claimed
CN-112851526-B Organic-inorganic hybrid metal halide luminescent material and preparation method thereof 北京科技大学 2022-09-06 CN claimed
JP-2002500641-A 2002-01-08 JP claimed
EP-1155001-A1 ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES TREGA BIOSCIENCES, INC. (US) 2001-11-21 EP claimed
WO-2000050406-A1 ISOQUINOLINE DERIVATIVES AND ISOQUINOLINE COMBINATORIAL LIBRARIES LION BIOSCIENCE AG (DE) 2000-08-31 WO claimed
CN-1259119-A Substituted 3, 3-diamino-2-propenenitriles, their preparation and use NOVO NORDISK AS (DK) 2000-07-05 CN claimed
EP-0998451-A1 SUBSTITUTED 3,3-DIAMINO-2-PROPENENITRILES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-05-10 EP claimed
EP-0635508-B1 TETRAHYDROPYRIDINE DERIVATIVE HAVING SUBSTITUENTS ON THREE RINGS ASAHI CHEMICAL IND (JP) 1999-10-06 EP claimed
US-5908960-A Compounds SMITHKLINE BEECHAM CORPORATION (US) 1999-06-01 US claimed
WO-1998050344-A1 SUBSTITUTED 3,3-DIAMINO-2-PROPENENITRILES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1998-11-12 WO claimed
EP-0635508-A1 TETRAHYDROPYRIDINE DERIVATIVE HAVING SUBSTITUENTS ON THREE RINGS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1995-01-25 EP claimed
US-4675026-A POLYETHERS HUELS AKTIENGESELLSCHAFT (DE) 1987-06-23 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-20230257344-A1 SULFONIC ACID-MODIFIED POLYISOCYANATE AND PREPARATION METHOD THEREFOR TST, SULT1A1, SULT2A1 EPHX1 4414/4885LIPA 866/4885APOBEC3A 3795/4885
US-12559453-B2 Sulfonic acid-modified polyisocyanate and preparation method therefor TMT1A, SRMS, FTO EPHX1 4673/4885LIPA 3224/4885APOBEC3A 3589/4885

“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.