SCHEMBL476988

SCHEMBL476988

Cc1cccc(C)c1[C]=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.43
CYP2A6 P11509 2/20 0.43
CYP3A4 P08684 1/20 0.42
TSHR P16473 5/20 0.42
ACHE P22303 2/20 0.42
ALDH1A1 P00352 6/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CYP2C19 P33261 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TRPA1 O75762 2/20 0.36
CD44 P16070 1/20 0.36
ATM Q13315 1/20 0.36
FFAR1 O14842 1/20 0.35
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL1698298 0.85 TSHR (0.39) CYP1A2CYP2A6CYP3A4TSHRACHE
SCHEMBL6149952 0.83 CD44 (0.50) CYP1A2CYP2A6CYP3A4TSHRACHE
SCHEMBL571847 0.83 TRPA1 (0.50) CYP1A2CYP2A6CYP3A4TSHRALDH1A1
SCHEMBL910072 0.83 ALDH1A1 (0.41) CYP1A2CYP2A6CYP3A4TSHRALDH1A1
SCHEMBL21201383 0.83 ACHE (0.48) CYP1A2CYP2A6CYP3A4TSHRACHE
SCHEMBL11508761 0.81 CYP3A4 (0.39) CYP1A2CYP3A4TSHRACHETRPA1
SCHEMBL1535598 0.81 GABRA1 (0.45) CYP1A2CYP2A6CYP3A4ALDH1A1TDP1
SCHEMBL18191838 0.78 ALDH1A1 (0.39) CYP1A2CYP2A6CYP3A4TSHRALDH1A1
SCHEMBL5176727 0.78 GABRA1 (0.35) CYP1A2CYP2A6CYP3A4ALDH1A1CA1
SCHEMBL10533625 0.78 GAA (0.37) CYP1A2CYP2A6CYP3A4TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4347728-A1 UV LED FREE RADICAL CURABLE INKJET INKS AGFA NV (BE) 2024-04-10 EP claimed
US-20240033318-A1 PEPTIDYL INHIBITORS OF CALCINEURIN-NFAT INTERACTION OHIO STATE INNOVATION FOUNDATION 2024-02-01 US claimed
US-20240025931-A1 Acylphosphine Oxide Photoinitiators and Applications Thereof AGFA NV (BE) 2024-01-25 US claimed
CN-117440994-A UV LED free radical curable inkjet ink 爱克发有限公司 2024-01-23 CN claimed
US-20230416547-A1 UV Curable Inkjet Inks and Inkjet Printing Methods AGFA NV (BE) 2023-12-28 US claimed
WO-2023232305-A1 INKJET PRINTING METHODS AGFA NV (BE) 2023-12-07 WO claimed
EP-4286483-A1 INKJET PRINTING METHODS AGFA NV (BE) 2023-12-06 EP claimed
EP-4247824-A1 ACYLPHOSPHINE OXIDE PHOTOINITIATORS AND APPLICATIONS THEREOF AGFA NV (BE) 2023-09-27 EP claimed
EP-4247903-A1 UV CURABLE INKJET INKS AND INKJET PRINTING METHODS AGFA NV (BE) 2023-09-27 EP claimed
CN-116438189-A Acyl phosphine oxide photoinitiator and application thereof 爱克发有限公司 2023-07-14 CN claimed
WO-1993018003-A1 SUBSTITUED PIPECOLINIC ACID DERIVATIVES AS HIV PROTEASE INHIBITORS BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1993-09-16 WO claimed
EP-0560268-A1 Substituted pipecolinic acid derivatives as HIV protease inhibitors BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) 1993-09-15 EP claimed
US-5049551-A Antitumor UBE INDUSTRIES, LTD. (JP) 1991-09-17 US claimed
EP-0400610-A1 5-Fluorouracil derivatives UBE INDUSTRIES, LTD. (JP) 1990-12-05 EP claimed
US-4456755-A ANTIBIOTICS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1984-06-26 US claimed
EP-0075629-A1 Imidazole derivatives, their preparation, and their pharmaceutical compositions Sumitomo Chemical Industries Ltd. (JP) 1983-04-06 EP claimed
US-4361514-A Carbon analogs of penicillin MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1982-11-30 US claimed
US-4282149-A Carbon and oxygen analogs of penicillin MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1981-08-04 US claimed
US-4087444-A Amides as ovulation inhibitors ELI LILLY AND COMPANY (US) 1978-05-02 US claimed
US-3975532-A ANALGESIC ICI UNITED STATES INC. (US) 1976-08-17 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20240025931-A1 Acylphosphine Oxide Photoinitiators and Applications Thereof DDO, PAM, SAT1 CYP1A2 3478/4885CYP2A6 2784/4885CYP3A4 2409/4885
US-20240033318-A1 PEPTIDYL INHIBITORS OF CALCINEURIN-NFAT INTERACTION CHP1, NFATC1, PPP3R1 CYP1A2 4838/4885CYP2A6 3581/4885CYP3A4 4535/4885

“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.