SCHEMBL16276010

SCHEMBL16276010

O=[N+]([O-])c1ccccc1-c1cc2c3ccccc3oc2c2c1oc1ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.54
▸ LMNA P02545 1/20 0.54
▸ MEN1 O00255 6/20 0.44
▸ KMT2A Q03164 6/20 0.44
▸ MAPT P10636 5/20 0.44
▸ F2 P00734 1/20 0.44
▸ C1R P00736 1/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ GAA P10253 4/20 0.43
▸ GABRP O00591 1/20 0.43
▸ GABRD O14764 1/20 0.43
▸ GABRA1 P14867 1/20 0.43
▸ GABRB1 P18505 1/20 0.43
▸ GABRG2 P18507 1/20 0.43
▸ GABRB3 P28472 1/20 0.43
▸ GABRA5 P31644 1/20 0.43
▸ GABRA3 P34903 1/20 0.43
▸ GABRA2 P47869 1/20 0.43
▸ GABRB2 P47870 1/20 0.43
▸ GABRA4 P48169 1/20 0.43

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
SCHEMBL18086411 0.85 ALDH1A1 (0.53) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL17451748 0.83 ALDH1A1 (0.53) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL19863146 0.83 ALDH1A1 (0.53) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL24171432 0.82 ALDH1A1 (0.50) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL782755 0.81 ALDH1A1 (0.57) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL29506802 0.81 ALDH1A1 (0.57) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL18086410 0.80 ALDH1A1 (0.59) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL26430962 0.80 ALDH1A1 (0.50) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL17706811 0.80 ALDH1A1 (0.58) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL16275781 0.79 ALDH1A1 (0.45) ALDH1A1LMNAMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9991445-B2 Heterocyclic compound, material for organic electroluminescence device including the same, and organic electroluminescence device and electronic equipment employing the same IDEMITSU KOSAN CO., LTD. (JP) 2018-06-05 — — US disclosed
US-20140353640-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2014-12-04 — — US disclosed
US-20140353640-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2014-12-04 — — US disclosed
Send feedback