SCHEMBL19984033

SCHEMBL19984033

CC(C)c1ccc2c(c1)sc1cc(C(C)(C)C)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SCN4A P35499 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PARP15 Q460N3 1/20 0.35
PARP10 Q53GL7 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
KIF11 P52732 4/20 0.34
ALDH1A1 P00352 4/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HIF1A Q16665 2/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
PLA2G1B P04054 1/20 0.33
NFKB1 P19838 1/20 0.33
CASP3 P42574 1/20 0.33

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
SCHEMBL24422194 0.92 RAB9A (0.36) NPC1RAB9ASCN4ASMN1; SMN2PARP15
SCHEMBL29317166 0.92 RAB9A (0.33) NPC1RAB9ASCN4ASMN1; SMN2KIF11
SCHEMBL2706410 0.85 ALDH1A1 (0.43) NPC1RAB9ASMN1; SMN2KIF11ALDH1A1
SCHEMBL13084833 0.85 RAB9A (0.48) NPC1RAB9ASCN4ASMN1; SMN2PARP15
SCHEMBL25688280 0.84 KIF11 (0.31) KIF11ALDH1A1HPGDALOX15HSD17B10
SCHEMBL25887232 0.83 KIF11 (0.38) NPC1RAB9ASCN4ASMN1; SMN2PARP15
SCHEMBL24604645 0.78 KIF11 (0.42) NPC1RAB9ASMN1; SMN2KIF11ALDH1A1
SCHEMBL24617810 0.77 KIF11 (0.37) NPC1RAB9ASMN1; SMN2KIF11ALDH1A1
SCHEMBL24051076 0.77 TSHR (0.46) NPC1RAB9AKIF11ALDH1A1HPGD
SCHEMBL13338346 0.77 GPR3 (0.54) NPC1RAB9ASCN4ASMN1; SMN2PARP15

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
US-20230320205-A1 NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE, AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-10-05 US disclosed
US-11778901-B2 Organic electroluminescent material and organic electroluminescent device comprising same SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-10-03 US disclosed
US-20220220049-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2022-07-14 US disclosed
US-11165029-B2 Amine compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2021-11-02 US disclosed
US-20180083209-A1 AMINE COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-22 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 (5 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-20220220049-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS HCN2, EPCAM, EFNA1 NPC1 2470/4885RAB9A 111/4885SCN4A 2648/4885
US-20180083209-A1 AMINE COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME PNMT, PIEZO1, ODC1 NPC1 4139/4885RAB9A 2711/4885SCN4A 3033/4885
US-11778901-B2 Organic electroluminescent material and organic electroluminescent device comprising same MAOA, AOC1, AOC2 NPC1 3457/4885RAB9A 1560/4885SCN4A 1974/4885
US-11165029-B2 Amine compound and organic electroluminescence device including the same PNMT, PIEZO1, ODC1 NPC1 4139/4885RAB9A 2711/4885SCN4A 3033/4885
US-20230320205-A1 NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE, AND ELECTRONIC APPARATUS NOM1, MNS1, NOS1 NPC1 1653/4885RAB9A 1840/4885SCN4A 747/4885

“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.