SCHEMBL7057715

SCHEMBL7057715

CCCCCCCCCCC(=O)OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
MCHR1 Q99705 1/20 0.46
LMNA P02545 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
ALB P02768 1/20 0.43
CYP2C9 P11712 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 3/20 0.43
RAB9A P51151 1/20 0.43
MEN1 O00255 1/20 0.43
DGKA P23743 1/20 0.42
PLA2G2C Q5R387 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL8210289 1.00 ALDH1A1 (0.48) ALDH1A1MCHR1LMNATDP1ALB
Ammonia Solution, Strong SCHEMBL27383584 0.98 ALDH1A1 (0.47) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL8208205 0.98 ALDH1A1 (0.46) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL27659885 0.94 ALDH1A1 (0.47) ALDH1A1MCHR1LMNATDP1ALB
Water SCHEMBL14635602 0.92 KMT2A (0.46) ALDH1A1MCHR1LMNATDP1ALB
SCHEMBL10730060 0.92 FAAH (0.48) KMT2AMEN1
SCHEMBL9808856 0.92 FAAH (0.48) KMT2AMEN1
SCHEMBL1914560 0.92 FAAH (0.48) KMT2AMEN1
SCHEMBL7182276 0.89 DGKA (0.43) ALDH1A1LMNADGKACA1CA2
SCHEMBL7187298 0.89 DGKA (0.43) ALDH1A1LMNADGKACA1CA2

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118284604-A Fused heterocycles as RIPK1 inhibitors 比西切姆有限公司 2024-07-02 CN disclosed
CN-117715905-A Checkpoint kinase 1 (CHK 1) inhibitors and uses thereof 无界生物公司 2024-03-15 CN disclosed
CN-117545751-A 2, 4-diaminopyrimidine derivatives as ULK1/2 inhibitors and their use 生命爱科 2024-02-09 CN disclosed
CN-116574099-A Phosphodiesterase inhibitors and uses 南京征祥医药有限公司 2023-08-11 CN disclosed
CN-116496279-A Isotopically labelled trapidil derivatives 希诺皮亚生物科学公司 2023-07-28 CN disclosed
CN-116406356-A Process for the preparation of 6- (4-nitro-phenoxy) -2H-pyridazin-3-one and 6- (4-amino-phenoxy) -2H-pyridazin-3-one derivatives as intermediates for thyroid hormone analogues 马德里加尔制药公司 2023-07-07 CN disclosed
US-20230107941-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS VenatoRx Pharmaceuticals, Inc. 2023-04-06 US disclosed
CN-115215923-A Macrocyclic broad spectrum antibiotics 豪夫迈·罗氏有限公司 2022-10-21 CN disclosed
CN-114401719-A Inhibitors of cyclin-dependent kinase 7 and uses thereof 达纳-法伯癌症研究所股份有限公司 2022-04-26 CN disclosed
CN-114206861-A Fused heteroaryl compounds useful as RIPK1 inhibitors 比西切姆有限公司 2022-03-18 CN disclosed
CN-113383078-A Oligonucleotide compositions and methods thereof 波涛生命科学有限公司 2021-09-10 CN disclosed
WO-2021119081-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS VenatoRx Pharmaceuticals, Inc. (US) 2021-06-17 WO disclosed
CN-107207514-B Fused heteroaryl compounds and their use as TRK inhibitors 康联制药有限公司 2020-01-24 CN disclosed
US-20030022811-A1 Favorable modulation of health-related quality of life and health-related quality-adjusted time-to-progression of disease in patients with prostate cancer ABBOTT LABORATORIES 2003-01-30 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 (1 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-20230107941-A1 HEPATITIS B CAPSID ASSEMBLY MODULATORS HAVCR2, COPB1, HDLBP ALDH1A1 3850/4885MCHR1 4201/4885LMNA 2483/4885

“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.