SCHEMBL20222816

SCHEMBL20222816

c1ccc(-c2cc(-c3ccc4c(c3)-c3ccccc3Sc3ccccc3-c3ccccc3-c3ccccc3-4)nc(-c3cccnc3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 3/20 0.44
▸ ALDH1A1 P00352 10/20 0.44
▸ MAPT P10636 7/20 0.44
▸ POLB P06746 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ KDM4E B2RXH2 6/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ GLA P06280 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ HPGD P15428 6/20 0.40
▸ NPC1 O15118 4/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ LMNA P02545 4/20 0.39
▸ DHODH Q02127 1/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39

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
SCHEMBL20222814 0.95 CYP19A1 (0.48) CYP19A1ALDH1A1MAPTPOLBTSHR
SCHEMBL20222625 0.94 CYP19A1 (0.47) CYP19A1ALDH1A1MAPTPOLBTSHR
SCHEMBL20222817 0.90 CYP19A1 (0.43) CYP19A1ALDH1A1MAPTPOLBTSHR
SCHEMBL20222630 0.90 CYP19A1 (0.43) CYP19A1ALDH1A1MAPTPOLBTSHR
SCHEMBL20222566 0.88 MEN1 (0.50) ALDH1A1MAPTKDM4ERAB9AGLA
SCHEMBL20845327 0.87 ALDH1A1 (0.43) CYP19A1ALDH1A1MAPTPOLBTSHR
SCHEMBL20222672 0.87 MEN1 (0.47) ALDH1A1MAPTTSHRKDM4ERAB9A
SCHEMBL20222813 0.86 CYP19A1 (0.42) CYP19A1ALDH1A1MAPTPOLBTSHR
SCHEMBL20222670 0.85 MEN1 (0.44) ALDH1A1MAPTKDM4ERAB9AGLA
SCHEMBL20222579 0.84 DHODH (0.41) CYP19A1ALDH1A1MAPTTSHRKDM4E

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-10693077-B2 Compound and organic electronic device using the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2020-06-23 — — US disclosed
US-20180155312-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME NICHEM FINE TECHNOLOGY CO., LTD. (TW) 2018-06-07 — — 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-10693077-B2 Compound and organic electronic device using the same SOD1, SCO2, RCOR3 CYP19A1 485/4885ALDH1A1 1162/4885MAPT 3350/4885
US-20180155312-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME SOD1, SCO2, RCOR3 CYP19A1 485/4885ALDH1A1 1162/4885MAPT 3350/4885

“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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