SCHEMBL18630342

SCHEMBL18630342

Cc1nncc2cccc(I)c12

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.32
MAPT P10636 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GRM5 P41594 1/20 0.31
SMN1; SMN2 Q16637 3/20 0.31
NPC1 O15118 2/20 0.31
TP53 P04637 2/20 0.31
CYP3A4 P08684 2/20 0.31
GOT1 P17174 2/20 0.31
RAB9A P51151 2/20 0.31
PDPK1 O15530 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MPO P05164 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
PKM P14618 1/20 0.31
MAOA P21397 1/20 0.31
PTGS1 P23219 1/20 0.31
THPO P40225 1/20 0.31

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
SCHEMBL18630363 0.80 KDM4E (0.32) KDM4EMAPTSMN1; SMN2NPC1TP53
SCHEMBL8404451 0.80 ALDH1A1 (0.38) KDM4EMAPTNPSR1GRM5SMN1; SMN2
SCHEMBL23946239 0.73 TNF (0.41) KDM4EMAPTGRM5SMN1; SMN2NPC1
SCHEMBL18848443 0.71 CYP2A6 (0.48) KDM4EMAPTNPSR1CYP3A4PDPK1
SCHEMBL18599583 0.71 ROCK2 (0.37) KDM4ECYP3A4PDPK1ALDH1A1TYMS
SCHEMBL18630336 0.71 NOS1 (0.37) KDM4EMAPTGRM5SMN1; SMN2NPC1
SCHEMBL18848566 0.67 PDPK1 (0.34) KDM4ECYP3A4PDPK1ALDH1A1LMNA
SCHEMBL291004 0.67 LMNA (0.52) KDM4EMAPTGRM5SMN1; SMN2NPC1
SCHEMBL1187747 0.66 ALDH1A1 (0.53) KDM4EMAPTTP53CYP3A4PDPK1
SCHEMBL29683465 0.66 ALDH1A1 (0.53) KDM4EMAPTTP53CYP3A4PDPK1

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-10249830-B2 Carbazole-based compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2019-04-02 US disclosed
US-20170077419-A1 CARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY 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 (2 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-10249830-B2 Carbazole-based compound and organic light-emitting device including the same OCIAD1, OXA1L, OCIAD2 KDM4E 3223/4885MAPT 1393/4885NPSR1 4519/4885
US-20170077419-A1 CARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME OCIAD1, OXA1L, CYP1A1 KDM4E 3224/4885MAPT 1280/4885NPSR1 4551/4885

“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.