SCHEMBL1433274

SCHEMBL1433274

CN1CCN(c2ccc(I)cc2)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.63
▸ GAA P10253 3/20 0.63
▸ ALDH1A1 P00352 2/20 0.63
▸ KDM4E B2RXH2 2/20 0.63
▸ PTK2B Q14289 2/20 0.63
▸ KMT2A Q03164 2/20 0.63
▸ ADRA2C P18825 2/20 0.63
▸ GFER P55789 1/20 0.63
▸ ESR2 Q92731 1/20 0.63
▸ SIRT6 Q8N6T7 1/20 0.53
▸ APP P05067 1/20 0.51
▸ CHKA P35790 1/20 0.50
▸ HTR3A P46098 1/20 0.50
▸ LMNA P02545 2/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ AKR1C3 P42330 1/20 0.49
▸ MAPK1 P28482 1/20 0.48

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
SCHEMBL25888837 0.94 ALDH1A1 (0.57) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL24518338 0.92 CHKA (0.62) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL14345952 0.88 AKR1C3 (0.57) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL15268156 0.82 ADRB1 (0.57) MAPTALDH1A1KMT2ALMNANPC1
SCHEMBL23422581 0.82 L3MBTL3 (0.53) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL24596956 0.82 L3MBTL3 (0.58) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL15489560 0.79 MAPT (0.65) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL81814 0.79 MAPT (0.65) MAPTGAAALDH1A1KDM4EPTK2B
SCHEMBL625677 0.78 ALDH1A1 (0.54) MAPTGAAALDH1A1KDM4EKMT2A
SCHEMBL18815076 0.78 LTA4H (0.52) MAPTGAAALDH1A1KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4620954-A1 CDK2 INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF Shandong Luye Pharmaceutical Co., Ltd. (CN) 2025-09-24 — — EP disclosed
WO-2024104455-A1 CDK2 INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF 山东绿叶制药有限公司 2024-05-23 — — WO disclosed
WO-2023192901-A9 QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS ESCIENT PHARMACEUTICALS, INC. (US) 2023-12-14 — — WO disclosed
EP-3755689-B1 INHIBITORS OF EGFR AND METHODS OF USE THEREOF DANA FARBER CANCER INST INC (US) 2023-12-06 — — EP disclosed
WO-2023192901-A1 QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS ESCIENT PHARMACEUTICALS, INC. (US) 2023-10-05 — — WO disclosed
WO-2023154282-A1 COMPOUNDS HAVING A T-STRUCTURE FORMED BY AT LEAST FOUR CYCLES FOR USE IN THE TREATMENT OF CANCER AND OTHER INDICATIONS THERAS, INC. (US) 2023-08-17 — — WO disclosed
US-11584746-B2 Inhibitors of EGFR and methods of use thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-02-21 — — US disclosed
US-11584746-B2 Inhibitors of EGFR and methods of use thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-02-21 — — US disclosed
WO-2023011610-A1 BENZODIOXANE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 南京红云生物科技有限公司 2023-02-09 — — WO disclosed
US-20220347299-A1 FLUORESCENT SYSTEMS FOR BIOLOGICAL IMAGING AND USES THEREOF LightOx Limited (GB) 2022-11-03 — — US disclosed
US-20150166525-A1 BENZENE OR THIOPHENE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R TECH UENO LTD (JP) 2015-06-18 — — US disclosed
US-8999989-B2 Benzene or thiophene derivative and use thereof as VAP-1 inhibitor R-TECH UENO, LTD. (JP) 2015-04-07 — — US disclosed
US-8999989-B2 Benzene or thiophene derivative and use thereof as VAP-1 inhibitor R-TECH UENO, LTD. (JP) 2015-04-07 — — US disclosed
US-8999989-B2 Benzene or thiophene derivative and use thereof as VAP-1 inhibitor R-TECH UENO, LTD. (JP) 2015-04-07 — — US disclosed
EP-2300430-A1 BENZENE OR THIOPHENE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R-Tech Ueno, Ltd. (JP) 2011-03-30 — — EP disclosed
US-20110059957-A1 BENZENE OR THIOPHENE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R-TECH UENO, LTD. (JP) 2011-03-10 — — US disclosed
US-20110059957-A1 BENZENE OR THIOPHENE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R-TECH UENO, LTD. (JP) 2011-03-10 — — US disclosed
US-20110059957-A1 BENZENE OR THIOPHENE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R-TECH UENO, LTD. (JP) 2011-03-10 — — US disclosed
WO-2009145360-A1 BENZENE OR THIOPHENE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R-TECH UENO, LTD. (JP) 2009-12-03 — — WO disclosed
US-5725838-A Radiolabeled D4 receptor ligands RESOLUTION PHARMACEUTICALS, INC. (CA) 1998-03-10 — — 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 (4 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-20150166525-A1 BENZENE OR THIOPHENE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR VAPB, VAPA, BET1 MAPT 1522/4885GAA 2070/4885ALDH1A1 141/4885
US-11584746-B2 Inhibitors of EGFR and methods of use thereof EGFR, ERBB2, ERBB3 MAPT 1297/4885GAA 1074/4885ALDH1A1 2938/4885
US-20110059957-A1 BENZENE OR THIOPHENE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR VAPB, VAPA, BET1 MAPT 1522/4885GAA 2070/4885ALDH1A1 141/4885
US-20220347299-A1 FLUORESCENT SYSTEMS FOR BIOLOGICAL IMAGING AND USES THEREOF SON, DNER, CASR MAPT 1497/4885GAA 4720/4885ALDH1A1 1816/4885

“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.

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