SCHEMBL18624564

SCHEMBL18624564

O=[N+]([O-])c1ccccc1-c1nc(Cl)nc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.53
▸ MEN1 O00255 4/20 0.53
▸ MAPT P10636 4/20 0.53
▸ GUSB P08236 1/20 0.53
▸ F2 P00734 1/20 0.53
▸ C1R P00736 1/20 0.53
▸ OPRK1 P41145 1/20 0.50
▸ CFTR P13569 1/20 0.49
▸ ALDH1A1 P00352 6/20 0.47
▸ TDP1 Q9NUW8 3/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ KLK3 P07288 1/20 0.45
▸ MAOB P27338 1/20 0.43
▸ POLB P06746 2/20 0.42
▸ ABCG2 Q9UNQ0 1/20 0.41
▸ NPC1 O15118 1/20 0.40

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
SCHEMBL18624563 0.81 ABCG2 (0.59) KMT2AMEN1MAPTGUSBF2
SCHEMBL17034869 0.76 KMT2A (0.50) KMT2AMEN1MAPTGUSBF2
SCHEMBL15860268 0.74 ALDH1A1 (0.54) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL19257502 0.74 KDM4E (0.58) KMT2AMEN1MAPTOPRK1ALDH1A1
SCHEMBL29572574 0.74 ALDH1A1 (0.54) KMT2AMEN1MAPTALDH1A1TDP1
SCHEMBL8818345 0.74 ALDH1A1 (0.51) KMT2AMEN1MAPTGUSBF2
SCHEMBL27700652 0.73 KMT2A (0.71) KMT2AMEN1MAPTGUSBOPRK1
SCHEMBL3772243 0.73 ADORA2A (0.66) MAPTC1RALDH1A1RAB9AMAPK1
SCHEMBL18646843 0.73 KDM4E (0.57) KMT2AMEN1MAPTOPRK1ALDH1A1
SCHEMBL22607267 0.73 KDM4E (0.53) KMT2AMAPTGUSBC1RALDH1A1

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-20170077416-A1 COMPOUND, ORGANIC OPTOELECTRONIC DIODE COMPRISING SAME, AND DISPLAY SAMSUNG SDI CO., LTD. (KR) 2017-03-16 — — US disclosed
US-20170077416-A1 COMPOUND, ORGANIC OPTOELECTRONIC DIODE COMPRISING SAME, AND DISPLAY SAMSUNG SDI CO., LTD. (KR) 2017-03-16 — — 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 (1 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-20170077416-A1 COMPOUND, ORGANIC OPTOELECTRONIC DIODE COMPRISING SAME, AND DISPLAY OR10J3, OR51E2, ODC1 KMT2A 2018/4885MEN1 2135/4885MAPT 1150/4885

“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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