SCHEMBL25629337

SCHEMBL25629337

Nc1ccc(-c2ccc(-c3ccccc3)c(-c3ccccc3)c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.65
TAAR1 Q96RJ0 2/20 0.65
CYP3A4 P08684 2/20 0.65
TDP1 Q9NUW8 2/20 0.65
MAOA P21397 1/20 0.52
MAPT P10636 4/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 2/20 0.48
HTT P42858 2/20 0.48
APAF1 O14727 1/20 0.48
THRB P10828 1/20 0.48
XBP1 P17861 1/20 0.48
PTBP1 P26599 1/20 0.48
GALK1 P51570 1/20 0.48
BLM P54132 1/20 0.48
SMAD3 P84022 1/20 0.48

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
SCHEMBL25692996 1.00 HSD17B10 (0.65) HSD17B10TAAR1CYP3A4TDP1MAOA
SCHEMBL1727313 0.92 CYP3A4 (0.60) HSD17B10TAAR1CYP3A4TDP1MAOA
SCHEMBL5459730 0.91 CYP3A4 (0.65) HSD17B10TAAR1CYP3A4TDP1MAOA
SCHEMBL29458681 0.91 CYP3A4 (0.65) HSD17B10TAAR1CYP3A4TDP1MAOA
SCHEMBL30670342 0.91 CYP3A4 (0.65) HSD17B10TAAR1CYP3A4TDP1MAOA
SCHEMBL30443313 0.91 TDP1 (0.58) HSD17B10TAAR1CYP3A4TDP1MAPT
SCHEMBL22898969 0.91 TAAR1 (0.54) HSD17B10TAAR1CYP3A4TDP1MAOA
SCHEMBL25301803 0.89 HSD17B10 (0.61) HSD17B10TAAR1CYP3A4TDP1MAOA
SCHEMBL650894 0.89 CYP3A4 (0.61) HSD17B10TAAR1CYP3A4TDP1MAOA
SCHEMBL21582646 0.89 HSD17B10 (0.61) HSD17B10TAAR1CYP3A4TDP1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106981661-A Preparation method of lithium ion battery electrode material 南京工业大学 2017-07-25 CN claimed
US-20240215281-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2024-06-27 US disclosed
CN-116349429-A Arylamine compound, organic electroluminescent element, and electronic device 保土谷化学工业株式会社 2023-06-27 CN disclosed
US-20230200222-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-06-22 US disclosed
US-11678569-B2 Compound, material for organic electroluminescent elements, organic electroluminescent element, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2023-06-13 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 (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-20230200222-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE PIEZO1, LEF1, L1CAM HSD17B10 3833/4885TAAR1 1169/4885CYP3A4 2378/4885
US-11678569-B2 Compound, material for organic electroluminescent elements, organic electroluminescent element, and electronic device PIEZO1, LEF1, L1CAM HSD17B10 3833/4885TAAR1 1169/4885CYP3A4 2378/4885
US-20240215281-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE OR10J3, L1CAM, RER1 HSD17B10 3769/4885TAAR1 1280/4885CYP3A4 1644/4885

“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.