SCHEMBL20098748

SCHEMBL20098748

Cc1ccc(-c2ccc(I)cn2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.49
▸ CCR1 P32246 1/20 0.48
▸ CCR5 P51681 1/20 0.48
▸ CCR8 P51685 1/20 0.48
▸ HDAC6 Q9UBN7 1/20 0.48
▸ AURKA O14965 1/20 0.43
▸ ABL1 P00519 1/20 0.43
▸ NTRK1 P04629 1/20 0.43
▸ LCK P06239 1/20 0.43
▸ CSF1R P07333 1/20 0.43
▸ RET P07949 1/20 0.43
▸ MET P08581 1/20 0.43
▸ PDGFRB P09619 1/20 0.43
▸ PIM1 P11309 1/20 0.43
▸ PDGFRA P16234 1/20 0.43
▸ FLT3 P36888 1/20 0.43
▸ MAPK8 P45983 1/20 0.43
▸ CDK8 P49336 1/20 0.43
▸ MAP2K1 Q02750 1/20 0.43
▸ MAP4K2 Q12851 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
SCHEMBL19018467 0.88 CCR1 (0.60) KDM1ACCR1CCR5CCR8HDAC6
SCHEMBL2477927 0.82 CCR1 (0.71) KDM1ACCR1CCR5CCR8HDAC6
SCHEMBL10000250 0.80 CCR1 (0.54) KDM1ACCR1CCR5CCR8HDAC6
SCHEMBL10000248 0.80 CCR1 (0.68) KDM1ACCR1CCR5CCR8HDAC6
SCHEMBL23474083 0.80 HPGDS (0.41) CCR1CCR5CCR8HDAC6MAPK14
SCHEMBL17051514 0.80 CCR1 (0.75) KDM1ACCR1CCR5CCR8HDAC6
SCHEMBL26551994 0.79 PDGFRB (0.40) KDM1ACCR1CCR5CCR8HDAC6
SCHEMBL23504950 0.79 CYP11B1 (0.43) KDM1ACYP3A4METAP2KMT2AMEN1
SCHEMBL20862075 0.79 NPC1 (0.53) AURKAABL1NTRK1LCKCSF1R
SCHEMBL23632228 0.79 KDM1A (0.49) KDM1AMETAP2KMT2AMEN1POLB

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-10224491-B2 Amine-based compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-05 — — US disclosed
US-9957441-B2 Amine-based compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-01 — — US disclosed
US-9960359-B2 Arylamine-based compound and organic light emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-01 — — 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-10224491-B2 Amine-based compound and organic light-emitting device including the same AOC2, TYR, TAAR1 KDM1A 145/4885CCR1 2658/4885CCR5 3158/4885

“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.

Send feedback