SCHEMBL18059686

SCHEMBL18059686

CC1(C)OB(c2cccnc2OC(F)F)OC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.46
LIPE Q05469 9/20 0.39
NR3C1 P04150 1/20 0.35
PGR P06401 1/20 0.35
ROCK2 O75116 1/20 0.32
LPL P06858 3/20 0.32
LIPG Q9Y5X9 3/20 0.32
DRD1 P21728 1/20 0.31
AAK1 Q2M2I8 1/20 0.31
F2 P00734 1/20 0.30
F10 P00742 1/20 0.30
F11 P03951 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
SCHEMBL29879003 1.00 TRPV4 (0.46) TRPV4LIPENR3C1PGRROCK2
SCHEMBL29140783 0.89 LIPE (0.35) TRPV4LIPEROCK2LPLLIPG
SCHEMBL1485098 0.87 LIPE (0.35) TRPV4LIPEROCK2LPLLIPG
SCHEMBL31441573 0.87 LIPE (0.35) TRPV4LIPEROCK2LPLLIPG
SCHEMBL30292561 0.81 APLNR (0.38) LIPEROCK2LPLLIPG
SCHEMBL1484864 0.81 APLNR (0.38) LIPEROCK2LPLLIPG
SCHEMBL29760199 0.81 LIPE (0.44) LIPEROCK2LPLLIPG
SCHEMBL29108916 0.81 LIPE (0.44) LIPEROCK2LPLLIPG
Water SCHEMBL2513501 0.80 APLNR (0.37) LIPEROCK2LPLLIPG
SCHEMBL365301 0.79 L3MBTL1 (0.36) LIPELPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12612409-B2 Pyrrolopyrimidines as CFTR potentiators CYSTIC FIBROSIS FOUNDATION (US) 2026-04-28 US disclosed
US-12570634-B2 Small molecule inhibitors of ubiquitin specific protease 1 (USP1) and uses thereof INSILICO MEDICINE IP LIMITED (HK) 2026-03-10 US disclosed
US-20250026754-A1 SMALL MOLECULE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 1 (USP1) AND USES THEREOF INSILICO MEDICINE IP LTD (CN) 2025-01-23 US disclosed
EP-4424311-A2 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS Cystic Fibrosis Foundation (US) 2024-09-04 EP disclosed
US-20240190839-A1 SMALL MOLECULE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 1 (USP1) AND USES THEREOF INSILICO MEDICINE IP LIMITED (HK) 2024-06-13 US disclosed
EP-3541390-B1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUND (US) 2024-05-01 EP disclosed
US-20240059689-A1 PURINE DERIVATIVES AS ANTICANCER AGENTS MEDIVIR AB (SE) 2024-02-22 US disclosed
EP-4308566-A1 PURINE DERIVATIVES AS ANTICANCER AGENTS Tango Therapeutics, Inc. (US) 2024-01-24 EP disclosed
CN-117425656-A Purine derivatives as anticancer agents 探戈医药股份有限公司 2024-01-19 CN disclosed
US-11739077-B2 Small molecule inhibitors of ubiquitin specific protease 1 (USP1) and uses thereof INSILICO MEDICINE IP LIMITED (HK) 2023-08-29 US disclosed
US-20190225621-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUNDATION 2019-07-25 US disclosed
US-10301315-B2 Pyrrolopyrimidines as CFTR potentiators CYSTIC FIBROSIS FOUNDATION THERAPEUTICS, INC. (US) 2019-05-28 US disclosed
EP-3070086-B1 AZAINDOLE DERIVATIVE TAIHO PHARMACEUTICAL CO LTD (JP) 2018-11-21 EP disclosed
WO-2018094137-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUNDATION THERAPEUTICS INC. (US) 2018-05-24 WO disclosed
US-20180141954-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUNDATION THERAPEUTICS, INC. (US) 2018-05-24 US disclosed
US-9782392-B2 Azaindole derivative TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-10-10 US disclosed
US-9676773-B2 Azaindole derivative TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-06-13 US disclosed
US-20170119743-A1 AZAINDOLE DERIVATIVE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-05-04 US disclosed
US-20160340353-A1 AZAINDOLE DERIVATIVE TAIHO PHARMARCEUTICAL CO., LTD. (JP) 2016-11-24 US disclosed
EP-3070086-A1 AZAINDOLE DERIVATIVE Taiho Pharmaceutical Co., Ltd. (JP) 2016-09-21 EP 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 (11 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-20240059689-A1 PURINE DERIVATIVES AS ANTICANCER AGENTS RRM2, TYMP, PNP TRPV4 4635/4885LIPE 4882/4885NR3C1 2404/4885
US-20170119743-A1 AZAINDOLE DERIVATIVE JAK3, JAK1, JAK2 TRPV4 4633/4885LIPE 4809/4885NR3C1 286/4885
US-20250026754-A1 SMALL MOLECULE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 1 (USP1) AND USES THEREOF USP1, USP2, USP28 TRPV4 4879/4885LIPE 1471/4885NR3C1 3875/4885
US-20240190839-A1 SMALL MOLECULE INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 1 (USP1) AND USES THEREOF USP1, USP2, USP28 TRPV4 4879/4885LIPE 1404/4885NR3C1 4152/4885
US-20190225621-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CFTR, P2RX1, P2RX5 TRPV4 199/4885LIPE 3228/4885NR3C1 1484/4885
US-12612409-B2 Pyrrolopyrimidines as CFTR potentiators CFTR, CLCN2, SLC26A3 TRPV4 159/4885LIPE 2492/4885NR3C1 912/4885
US-20160340353-A1 AZAINDOLE DERIVATIVE JAK3, JAK1, JAK2 TRPV4 3584/4885LIPE 4766/4885NR3C1 146/4885
US-10301315-B2 Pyrrolopyrimidines as CFTR potentiators CFTR, P2RX1, P2RX5 TRPV4 257/4885LIPE 3357/4885NR3C1 1577/4885
US-20180141954-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CFTR, P2RX1, P2RX5 TRPV4 257/4885LIPE 3357/4885NR3C1 1577/4885
US-11739077-B2 Small molecule inhibitors of ubiquitin specific protease 1 (USP1) and uses thereof USP1, USP2, USP28 TRPV4 4879/4885LIPE 1404/4885NR3C1 4152/4885
US-12570634-B2 Small molecule inhibitors of ubiquitin specific protease 1 (USP1) and uses thereof USP1, USP2, USP3 TRPV4 4796/4885LIPE 3450/4885NR3C1 2658/4885

“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.