SCHEMBL21233554

SCHEMBL21233554

NN(CCCCCCO)c1nc2ccccc2s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ILK Q13418 4/20 0.43
HDAC1 Q13547 2/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 4/20 0.41
UBE2T Q9NPD8 1/20 0.41
ASIC3 Q9UHC3 1/20 0.41
RAD52 P43351 1/20 0.39
GAA P10253 2/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 2/20 0.38

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
SCHEMBL21675451 1.00 ILK (0.43) ILKHDAC1NPC1RAB9ALMNA
SCHEMBL21675553 1.00 ILK (0.43) ILKHDAC1NPC1RAB9ALMNA
SCHEMBL21413246 1.00 ILK (0.43) ILKHDAC1NPC1RAB9ALMNA
SCHEMBL21675476 0.99 ILK (0.44) ILKHDAC1NPC1RAB9ALMNA
SCHEMBL23185864 0.94 NPC1 (0.43) ILKHDAC1NPC1RAB9ALMNA
SCHEMBL15722746 0.88 NPC1 (0.46) ILKNPC1RAB9ALMNASMN1; SMN2
SCHEMBL16705693 0.86 NPC1 (0.50) HDAC1NPC1RAB9ALMNASMN1; SMN2
SCHEMBL15722747 0.86 NPC1 (0.50) HDAC1NPC1RAB9ALMNASMN1; SMN2
SCHEMBL23185863 0.86 NPC1 (0.50) HDAC1NPC1RAB9ALMNASMN1; SMN2
SCHEMBL15722637 0.86 NPC1 (0.50) HDAC1NPC1RAB9ALMNASMN1; SMN2

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-114026078-B Novel polymerizable liquid crystal 罗利克技术有限公司 2024-06-07 CN disclosed
CN-114026078-A Novel polymerizable liquid crystal 罗利克技术有限公司 2022-02-08 CN disclosed
US-10968189-B2 Method for producing 2-hydrazinobenzothiazole derivative DIC CORPORATION (JP) 2021-04-06 US disclosed
US-10927087-B2 Method for producing polymerizable compound DIC CORPORATION (JP) 2021-02-23 US disclosed
US-10428032-B2 Polymerizable compound and optically anisotropic body DIC CORPORATION (JP) 2019-10-01 US disclosed
WO-2019151263-A1 METHOD FOR PRODUCING 1,1-DISUBSTITUTED HYDRAZINE COMPOUND AND METHOD FOR PRODUCING POLYMERIZABLE COMPOUND 日本ゼオン株式会社 2019-08-08 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 (3 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-10428032-B2 Polymerizable compound and optically anisotropic body CCNY, F12, CCNI ILK 1743/4885HDAC1 3861/4885NPC1 3592/4885
US-10927087-B2 Method for producing polymerizable compound INCENP, INF2, INHA ILK 732/4885HDAC1 538/4885NPC1 4131/4885
US-10968189-B2 Method for producing 2-hydrazinobenzothiazole derivative HAO2, IDH2, HACL2 ILK 2528/4885HDAC1 625/4885NPC1 2261/4885

“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.