SCHEMBL2657523

SCHEMBL2657523

N#Cc1cc(CO)ccc1F

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.43
TRPV4 Q9HBA0 2/20 0.42
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
DPP4 P27487 2/20 0.41
DPP8 Q6V1X1 1/20 0.41
AR P10275 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
VNN1 O95497 1/20 0.37
GRM4 Q14833 1/20 0.37
CNR2 P34972 1/20 0.37
DAO P14920 1/20 0.37
TRPV3 Q8NET8 1/20 0.36
CACNA1H O95180 2/20 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
SCHEMBL14719941 0.85 KDM4E (0.42) CYP11B1CYP11B2TRPV4DPP4DPP8
SCHEMBL21158608 0.84 PTGDR2 (0.48) PTGDR2ARMAOAMAOB
SCHEMBL3164050 0.84 CYP11B1 (0.58) CYP11B1CYP11B2PTGDR2TRPV4AR
SCHEMBL24872544 0.83 TRPV4 (0.45) CYP11B1CYP11B2TRPV4DPP4DPP8
SCHEMBL14663528 0.83 AR (0.55) CYP11B1CYP11B2PTGDR2ARMAOA
SCHEMBL13179910 0.82 TRPV4 (0.44) CYP11B1CYP11B2TRPV4DPP4DPP8
SCHEMBL8156844 0.81 MAOB (0.44) CYP11B1CYP11B2TRPV4ARMAOA
SCHEMBL15018389 0.80 TRPV4 (0.42) TRPV4DPP4DPP8ARMAOA
SCHEMBL19437205 0.80 TRPV4 (0.42) TRPV4DPP4DPP8ARMAOA
SCHEMBL51299 0.80 LOXL2 (0.47) TRPV4DPP4DPP8ARMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590062-B2 PD-1/PD-L1 inhibitors GILEAD SCIENCES, INC. (US) 2026-03-31 US disclosed
US-20240300965-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2024-09-12 US disclosed
WO-2024140850-A1 PROTEIN TYROSINE KINASE INHIBITOR AND MEDICAL USE THEREOF 苏州必扬医药科技有限公司 2024-07-04 WO disclosed
US-11999746-B2 Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2024-06-04 US disclosed
US-11629135-B2 Pyrimidine derivatives as inhibitors of PD1/PD-L1 activation JUBILANT PRODELL LLC (US) 2023-04-18 US disclosed
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed
US-20210323922-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2021-10-21 US disclosed
WO-2021197467-A1 MULTI-TARGET ANTI-TUMOR COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 上海华汇拓医药科技有限公司 2021-10-07 WO disclosed
US-20210179580-A1 PYRIMIDINE DERIVATIVES AS INHIBITORS OF PD1/PD-L1 ACTIVATION Jubilant Prodel LLC 2021-06-17 US disclosed
US-20210179580-A1 PYRIMIDINE DERIVATIVES AS INHIBITORS OF PD1/PD-L1 ACTIVATION Jubilant Prodel LLC 2021-06-17 US disclosed
WO-2007075847-A2 GLUCOKINASE ACTIVATORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-07-05 WO disclosed
WO-2007075847-A2 GLUCOKINASE ACTIVATORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-07-05 WO disclosed
EP-1040097-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2004-04-14 EP disclosed
US-6593335-B1 Disease than can be ameliorated with a potassium channel opener in a host mammal, comprising administering to the mammal in need thereof a therapeutically effective amount of the compound of claim 1; said disease is epilepsy, Raynaud's ABBOTT LABORATORIES 2003-07-15 US disclosed
EP-1194429-A1 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2002-04-10 EP disclosed
US-20010036950-A1 Potassium channel openers CARROLL WILLIAM A (US) 2001-11-01 US disclosed
US-6265417-B1 MUSCLE RELAXANTS ABBOTT LABORATORIES 2001-07-24 US disclosed
WO-2000078768-A1 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2000-12-28 WO disclosed
EP-1040097-A1 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2000-10-04 EP disclosed
WO-1999031059-A1 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 1999-06-24 WO 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-20210323922-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 CYP11B1 1842/4885CYP11B2 2218/4885PTGDR2 1652/4885
US-11629135-B2 Pyrimidine derivatives as inhibitors of PD1/PD-L1 activation PDCD1, CD274, PDCD1LG2 CYP11B1 350/4885CYP11B2 949/4885PTGDR2 2769/4885
US-20210179580-A1 PYRIMIDINE DERIVATIVES AS INHIBITORS OF PD1/PD-L1 ACTIVATION PDCD1, CD274, PDCD1LG2 CYP11B1 350/4885CYP11B2 949/4885PTGDR2 2769/4885
US-12590062-B2 PD-1/PD-L1 inhibitors CD274, PDCD1LG2, PDCD1 CYP11B1 1407/4885CYP11B2 2028/4885PTGDR2 3020/4885
US-20240300965-A1 COMPOUNDS PLAAT2, PLA2G12A, PLA2G1B CYP11B1 2496/4885CYP11B2 2549/4885PTGDR2 404/4885
US-20010036950-A1 Potassium channel openers KCNJ2, KCNJ11, KCNJ1 CYP11B1 735/4885CYP11B2 1040/4885PTGDR2 2511/4885
US-11999746-B2 Compounds PLAAT2, PLA2G12A, PLA2G1B CYP11B1 2496/4885CYP11B2 2549/4885PTGDR2 404/4885

“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.