SCHEMBL2215449

SCHEMBL2215449

OB(O)c1ccnn1C1CCCCO1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 5/20 0.47
CYP4A11 Q02928 5/20 0.47
ATR Q13535 12/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35

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
SCHEMBL3041585 0.88 CYP4F2 (0.40) CYP4F2CYP4A11ATRALDH1A1LMNA
SCHEMBL29987315 0.79 CYP4F2 (0.36) CYP4F2CYP4A11ATRRXRARXRB
SCHEMBL1649419 0.78 CYP4F2 (0.41) CYP4F2CYP4A11ATRRXRARXRB
SCHEMBL30739025 0.78 CYP4F2 (0.44) CYP4F2CYP4A11ATRALDH1A1LMNA
SCHEMBL2839522 0.77 CYP4F2 (0.42) CYP4F2CYP4A11ATRALDH1A1LMNA
SCHEMBL29953278 0.77 PKM (0.40) ALDH1A1LMNA
SCHEMBL24173879 0.76 ALDH1A1 (0.49) CYP4F2CYP4A11ATRALDH1A1LMNA
SCHEMBL18438313 0.76 CYP4F2 (0.50) CYP4F2CYP4A11ATRALDH1A1LMNA
SCHEMBL8004755 0.76 CYP4F2 (0.53) CYP4F2CYP4A11ATRALDH1A1LMNA
SCHEMBL18133767 0.76 CYP4F2 (0.47) CYP4F2CYP4A11ATRALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12391675-B2 NLRP3 modulators INNATE TUMOR IMMUNITY, INC. (US) 2025-08-19 US disclosed
US-12338228-B2 NLRP3 modulators INNATE TUMOR IMMUNITY, INC. (US) 2025-06-24 US disclosed
US-12171756-B2 NLRP3 modulators INNATE TUMOR IMMUNITY, INC. (US) 2024-12-24 US disclosed
EP-3652166-B1 NLRP3 MODULATORS INNATE TUMOR IMMUNITY INC (US) 2024-11-20 EP disclosed
US-20240317741-A1 NAPHTHYRIDINE DERIVATIVE AS ATR INHIBITOR AND METHOD FOR PREPARING SAME Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2024-09-26 US disclosed
WO-2024140851-A1 TOLL-LIKE RECEPTOR INHIBITOR, AND PREPARATION THEREFOR AND APPLICATION THEREOF 上海维申医药有限公司 2024-07-04 WO disclosed
EP-4385992-A1 NAPHTHYRIDINE DERIVATIVE AS ATR INHIBITOR AND METHOD FOR PREPARING SAME Wigen Biomedicine Technology (Shanghai) Co., Ltd. (CN) 2024-06-19 EP disclosed
EP-4126855-B1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTIONS HOFFMANN LA ROCHE (CH) 2024-04-24 EP disclosed
CN-117736222-A MTA synergistic PRMT5 inhibitor compounds having tricyclic or tetracyclic ring structures 烨辉医药科技(上海)有限公司 2024-03-22 CN disclosed
CN-117642401-A Naphthyridine derivatives as ATR inhibitors and methods of preparing same 微境生物医药科技(上海)有限公司 2024-03-01 CN disclosed
US-8314094-B2 Benzoxazinone derivative MSD K.K (JP) 2012-11-20 US disclosed
WO-2012126901-A1 BENZOXAZEPIN COMPOUNDS SELECTIVE FOR PI3K P110 DELTA AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-09-27 WO disclosed
WO-2012126901-A1 BENZOXAZEPIN COMPOUNDS SELECTIVE FOR PI3K P110 DELTA AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-09-27 WO disclosed
US-20120245144-A1 BENZOXAZEPIN COMPOUNDS SELECTIVE FOR PI3K P110 DELTA AND METHODS OF USE GENENTECH, INC. (US) 2012-09-27 US disclosed
US-20120245144-A1 BENZOXAZEPIN COMPOUNDS SELECTIVE FOR PI3K P110 DELTA AND METHODS OF USE GENENTECH, INC. (US) 2012-09-27 US disclosed
US-20110178064-A1 SPIRO CONDENSED BARBITURIC ACID DERIVATIVES FOR USE AS ANTIBACTERIAL ASTRAZENECA R&D (SE) 2011-07-21 US disclosed
US-20100210636-A1 BENZOXAZINONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. 2010-08-19 US disclosed
EP-2210880-A1 BENZOXAZINONE DERIVATIVE Banyu Pharmaceutical Co., Ltd. (JP) 2010-07-28 EP disclosed
EP-2178876-A1 SPIRO CONDENSED BARBITURIC ACID DERIVATIVES FOR USE AS ANTIBACTERIAL AstraZeneca AB (SE) 2010-04-28 EP disclosed
WO-2009010801-A1 SPIRO CONDENSED BARBITURIC ACID DERIVATIVES FOR USE AS ANTIBACTERIAL ASTRAZENECA UK LIMITED (GB) 2009-01-22 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-20110178064-A1 SPIRO CONDENSED BARBITURIC ACID DERIVATIVES FOR USE AS ANTIBACTERIAL TBCA, TUBA1A, BROX CYP4F2 2105/4885CYP4A11 1349/4885ATR 3344/4885
US-12338228-B2 NLRP3 modulators NLRP3, NLRP1, PYCARD CYP4F2 2752/4885CYP4A11 461/4885ATR 2944/4885
US-20240317741-A1 NAPHTHYRIDINE DERIVATIVE AS ATR INHIBITOR AND METHOD FOR PREPARING SAME ATR, ATRIP, TBK1 CYP4F2 4095/4885CYP4A11 2621/4885ATR 1/4885
US-12391675-B2 NLRP3 modulators NLRP3, NLRP1, PYCARD CYP4F2 1820/4885CYP4A11 259/4885ATR 3060/4885
US-20120245144-A1 BENZOXAZEPIN COMPOUNDS SELECTIVE FOR PI3K P110 DELTA AND METHODS OF USE PIK3CA, PIK3CD, PIK3R4 CYP4F2 1652/4885CYP4A11 69/4885ATR 2345/4885
US-20100210636-A1 BENZOXAZINONE DERIVATIVE HAX1, CYP4X1, CYP19A1 CYP4F2 205/4885CYP4A11 50/4885ATR 2978/4885
US-12171756-B2 NLRP3 modulators NLRP3, NLRP1, PYCARD CYP4F2 1583/4885CYP4A11 242/4885ATR 3043/4885

“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.