SCHEMBL21993650

SCHEMBL21993650

CCCCCCCCn1c(=O)c(-c2ccc(/C=C3\SC(=S)N(CC)C3=O)s2)cc2c1cc(-c1ccc(/C=C3\SC(=S)N(CC)C3=O)s1)c(=O)n2CCCCCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNFRSF1A P19438 1/20 0.52
▸ ALDH1A1 P00352 8/20 0.43
▸ MEN1 O00255 5/20 0.43
▸ MAPT P10636 5/20 0.43
▸ KMT2A Q03164 5/20 0.43
▸ LMNA P02545 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ IDE P14735 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ TNNI3 P19429 1/20 0.43
▸ TNNT2 P45379 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ TNNC1 P63316 1/20 0.43
▸ PDE4B Q07343 2/20 0.40
▸ PTPN22 Q9Y2R2 2/20 0.40
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ DNM1 Q05193 1/20 0.40
▸ MAPK1 P28482 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
SCHEMBL21993832 0.84 DNM1 (0.48) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL25165760 0.78 TNFRSF1A (0.62) TNFRSF1AALDH1A1MEN1MAPTKMT2A
SCHEMBL21993649 0.77 KDM4E (0.39) ALDH1A1MAPTKMT2ALMNANPC1
SCHEMBL3135706 0.73 TNFRSF1A (0.57) TNFRSF1AALDH1A1MEN1MAPTKMT2A
SCHEMBL3135714 0.73 TNFRSF1A (0.57) TNFRSF1AALDH1A1MEN1MAPTKMT2A
SCHEMBL3135718 0.73 TNFRSF1A (0.57) TNFRSF1AALDH1A1MEN1MAPTKMT2A
SCHEMBL21501987 0.73 KDM4E (0.38) ALDH1A1MAPTKMT2ANPC1MAPK1
SCHEMBL25165309 0.73 TNFRSF1A (0.59) TNFRSF1AALDH1A1MEN1MAPTKMT2A
SCHEMBL20714352 0.72 ALDH1A1 (0.59) TNFRSF1AALDH1A1KMT2APTPN22MAOA
SCHEMBL25165794 0.72 TNFRSF1A (0.47) TNFRSF1AALDH1A1MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11075344-B2 Organic device and image sensor SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-07-27 — — US disclosed
US-20200152888-A1 ORGANIC DEVICE AND IMAGE SENSOR SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-05-14 — — 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-20200152888-A1 ORGANIC DEVICE AND IMAGE SENSOR CHRM1, NCS1, OR10J3 TNFRSF1A 3259/4885ALDH1A1 254/4885MEN1 182/4885
US-11075344-B2 Organic device and image sensor CHRM1, NCS1, OR10J3 TNFRSF1A 3259/4885ALDH1A1 254/4885MEN1 182/4885

“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.

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