SCHEMBL1722167

SCHEMBL1722167

CCC1CCCC(CC)N1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
S1PR2 O95136 1/20 0.36
S1PR4 O95977 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
S1PR5 Q9H228 1/20 0.36
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
DPP4 P27487 2/20 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
SCHEMBL8290708 1.00 CYP2C9 (0.38) CYP2C9TSHRCYP2C19TDP1S1PR2
SCHEMBL4374384 0.87 S1PR2 (0.32) CYP2C9TSHRCYP2C19TDP1S1PR2
SCHEMBL13248929 0.87 FUCA1 (0.37) CYP2C9TSHRCYP2C19TDP1S1PR2
SCHEMBL1763282 0.87
SCHEMBL13535333 0.87
SCHEMBL2699869 0.84
SCHEMBL2699865 0.84
SCHEMBL2699867 0.84
SCHEMBL24449419 0.82
SCHEMBL22151837 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116516508-B Special material for high melt index random copolymer polypropylene fiber and preparation method thereof 锦州英诺威科技服务有限公司 2023-11-17 CN claimed
CN-116516508-A Special material for high melt index random copolymer polypropylene fiber and preparation method thereof 锦州英诺威科技服务有限公司 2023-08-01 CN claimed
CN-114560846-B Multifunctional chemical cross-linking agent and preparation method and application thereof 中国科学院大连化学物理研究所 2023-07-18 CN claimed
CN-103965381-B A kind of titanium tetrachloride initiator system altogether and the method being used for preparing high-activity polyisobutylene thereof 北京化工大学 2016-08-24 CN claimed
CN-103965381-A Titanium tetrachloride co-initiation system, and method for preparing high-reaction-activity polyisobutylene by using it UNIV BEIJING CHEMICAL 2014-08-06 CN claimed
CN-101613423-B Initiation system used for synthesizing polyisobutylene with high reaction activity UNIV BEIJING CHEMICAL 2011-05-18 CN claimed
CN-101613423-A A kind of initiator system that is used for synthesizing polyisobutylene with high reaction activity UNIV BEIJING CHEMICAL 2009-12-30 CN claimed
US-4785100-A BROMINATION FOLLOWED BY AMINATION HUELS AKTIENGESELLSHAFT (DE) 1988-11-15 US claimed
EP-0262348-A2 Process for the preparation of N-substituted morpholine and piperidine derivatives HÜLS AKTIENGESELLSCHAFT (DE) 1988-04-06 EP claimed
US-4634687-A COCATALYST FOR COORDINATION CATALYST TOA NENRYO KOGYO KABUSHIKI KAISHA (JP) 1987-01-06 US claimed
US-20260092138-A1 BLOCKED POLYISOCYANATE COMPOSITION, CURABLE RESIN COMPOSITION COMPRISING THE COMPOSITION, AND CURED PRODUCT KOEI CHEMICAL COMPANY, LIMITED (JP) 2026-04-02 US disclosed
US-20240287108-A1 nSMASE2 INHIBITOR PRODRUGS WITH ENHANCED ORAL AND BRAIN EXPOSURES THE JOHNS HOPKINS UNIVERSITY 2024-08-29 US disclosed
US-12037345-B2 Heterobicyclic compounds for inhibiting the activity of SHP2 TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-07-16 US disclosed
CN-116516508-B Special material for high melt index random copolymer polypropylene fiber and preparation method thereof 锦州英诺威科技服务有限公司 2023-11-17 CN disclosed
CN-116516508-A Special material for high melt index random copolymer polypropylene fiber and preparation method thereof 锦州英诺威科技服务有限公司 2023-08-01 CN disclosed
US-4382093-A 9-Aminoalkylfluorenes ELI LILLY AND COMPANY (US) 1983-05-03 US disclosed
US-4281120-A IMMUNE STIMULANTS GRUNENTHAL GMBH (DE) 1981-07-28 US disclosed
US-4277495-A FLUORENE 9-AMINOALKYL-9-CARBOXYLIC ACIDS OR ESTERS ELI LILLY AND COMPANY (US) 1981-07-07 US disclosed
US-4070461-A ANTICHOLESTEROL MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1978-01-24 US disclosed
US-3998808-A INSECTICIDES, FUNGICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-12-21 US 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 (3 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-20240287108-A1 nSMASE2 INHIBITOR PRODRUGS WITH ENHANCED ORAL AND BRAIN EXPOSURES SGMS2, SMPD2, CERS2 CYP2C9 2616/4885TSHR 4859/4885CYP2C19 2869/4885
US-20260092138-A1 BLOCKED POLYISOCYANATE COMPOSITION, CURABLE RESIN COMPOSITION COMPRISING THE COMPOSITION, AND CURED PRODUCT RER1, RPP30, REV1 CYP2C9 1887/4885TSHR 3522/4885CYP2C19 2584/4885
US-12037345-B2 Heterobicyclic compounds for inhibiting the activity of SHP2 PTPN1, PTPN9, PTPN7 CYP2C9 2409/4885TSHR 1359/4885CYP2C19 3748/4885

“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.