SCHEMBL22646172

SCHEMBL22646172

CCCCCCC(C)Nc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
CYP3A4 P08684 3/20 0.47
ALOX15 P16050 3/20 0.47
TSHR P16473 3/20 0.47
HSD17B10 Q99714 3/20 0.47
HIF1A Q16665 2/20 0.47
ALOX12 P18054 2/20 0.47
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 3/20 0.47
THRB P10828 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TP53 P04637 1/20 0.45
HSP90AA1 P07900 1/20 0.45
CASP1 P29466 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HDAC8 Q9BY41 6/20 0.43
HDAC3 O15379 4/20 0.43
HDAC6 Q9UBN7 4/20 0.43
HDAC1 Q13547 4/20 0.43
HDAC2 Q92769 3/20 0.43

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
SCHEMBL9355959 1.00 ALDH1A1 (0.47) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL9011314 1.00 ALDH1A1 (0.47) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL1453792 1.00 ALDH1A1 (0.47) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL1454054 1.00 ALDH1A1 (0.47) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL11264853 1.00 ALDH1A1 (0.47) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL1454393 1.00 ALDH1A1 (0.47) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL1455140 0.98 ALDH1A1 (0.49) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL809566 0.93 ALDH1A1 (0.58) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL38948 0.93 ALDH1A1 (0.58) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL11353374 0.93 ALDH1A1 (0.58) ALDH1A1CYP3A4ALOX15TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115087644-A Additive mixture for rheology modification of polymers 巴斯夫欧洲公司 2022-09-20 CN disclosed
CN-110678510-B Nucleating agents, methods of making the same and related polymer compositions 巴斯夫欧洲公司 2022-03-29 CN disclosed
US-11192865-B2 Benzosulfonyl compounds VIVACE THERAPEUTICS, INC. (US) 2021-12-07 US disclosed
CN-113637514-A Composition and method of forming the same 巴斯夫欧洲公司 2021-11-12 CN disclosed
CN-113597416-A Shaped synthetic polymer article 巴斯夫欧洲公司 2021-11-02 CN disclosed
US-20200354325-A1 BENZOSULFONYL COMPOUNDS VIVACE THERAPEUTICS, INC. 2020-11-12 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 (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-11192865-B2 Benzosulfonyl compounds YAP1, TEAD2, TEAD1 ALDH1A1 2161/4885CYP3A4 3226/4885ALOX15 3108/4885
US-20200354325-A1 BENZOSULFONYL COMPOUNDS YAP1, TEAD2, TEAD1 ALDH1A1 2161/4885CYP3A4 3226/4885ALOX15 3108/4885

“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.