SCHEMBL5097563

SCHEMBL5097563

Cc1ccn(-c2ccc(-c3ccccc3)cc2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.53
▸ HDAC4 P56524 1/20 0.50
▸ RAB9A P51151 6/20 0.48
▸ NPC1 O15118 5/20 0.48
▸ MAPT P10636 4/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ ATM Q13315 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ AVPR1A P37288 3/20 0.42
▸ AVPR2 P30518 2/20 0.42
▸ OXTR P30559 2/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ TSHR P16473 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ HSD17B10 Q99714 2/20 0.41
▸ TP53 P04637 1/20 0.41

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
SCHEMBL541634 0.88 MAPT (0.55) HTTHDAC4RAB9ANPC1MAPT
SCHEMBL14277962 0.84 RAB9A (0.49) HTTHDAC4RAB9ANPC1MAPT
SCHEMBL5963053 0.80 HTT (0.49) HTTHDAC4RAB9ANPC1MAPT
SCHEMBL12422701 0.79 HTT (0.59) HTTHDAC4RAB9ANPC1MAPT
SCHEMBL18725064 0.78 HTT (0.58) HTTHDAC4RAB9ANPC1MAPT
SCHEMBL16573989 0.78 RAB9A (0.49) RAB9ANPC1MAPTSMN1; SMN2L3MBTL1
SCHEMBL19366240 0.76 HDAC4 (0.64) HTTHDAC4RAB9ANPC1MAPT
SCHEMBL2615994 0.76 HTT (0.56) HTTHDAC4RAB9ANPC1MAPT
SCHEMBL5544146 0.76 HTT (0.56) HTTHDAC4RAB9ANPC1MAPT
SCHEMBL5539090 0.76 HTT (0.56) HTTHDAC4RAB9ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100497358-C Iridium compound and organic electroluminescent device using the same SAMSUNG SDI CO LTD (KR) 2009-06-10 — — CN disclosed
US-7332233-B2 Iridium compound and organic electroluminescent device using the same SAMSUNG SDI CO., LTD. (KR) 2008-02-19 — — US disclosed
US-7332233-B2 Iridium compound and organic electroluminescent device using the same SAMSUNG SDI CO., LTD. (KR) 2008-02-19 — — US disclosed
US-7332233-B2 Iridium compound and organic electroluminescent device using the same SAMSUNG SDI CO., LTD. (KR) 2008-02-19 — — US disclosed
CN-1626540-A Iridium compound and organic electroluminescent device using the same SAMSUNG SDI CO LTD (KR) 2005-06-15 — — CN disclosed
US-20050031903-A1 Iridium compound and organic electroluminescent device using the same SAMSUNG DISPLAY CO., LTD. (KR) 2005-02-10 — — 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-20050031903-A1 Iridium compound and organic electroluminescent device using the same IK, ALPL, PPIP5K2 HTT 3044/4885HDAC4 2388/4885RAB9A 1790/4885

“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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