SCHEMBL17084335

SCHEMBL17084335

CCCC1(CCC)c2cc(/C(=N/OC(=O)CCSC)c3ccccc3C)ccc2-c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ MAPT P10636 6/20 0.36
▸ KMT2A Q03164 5/20 0.36
▸ TDP1 Q9NUW8 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ GFER P55789 1/20 0.32

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
SCHEMBL17084344 0.90 NPC1 (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL17084345 0.88 NPC1 (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL17056217 0.88 NPC1 (0.44) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL18218064 0.88 NPC1 (0.44) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL17084342 0.87 ALDH1A1 (0.44) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL17084338 0.86 NPC1 (0.47) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL17084336 0.84 POLB (0.50) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL17084307 0.82 NPC1 (0.39) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL17084347 0.82 NPC1 (0.39) NPC1RAB9ASMN1; SMN2ALDH1A1POLB
SCHEMBL18812939 0.82 NPC1 (0.39) NPC1RAB9ASMN1; SMN2ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9684238-B2 Fluorene-type compound, photopolymerization initiator comprising said fluorene-type compound, and photosensitive composition containing said photopolymerization initiator TOKYO OHKA KOGYO CO., LTD. (JP) 2017-06-20 — — US disclosed
US-9684238-B2 Fluorene-type compound, photopolymerization initiator comprising said fluorene-type compound, and photosensitive composition containing said photopolymerization initiator TOKYO OHKA KOGYO CO., LTD. (JP) 2017-06-20 — — US disclosed
US-20150259321-A1 FLUORENE-TYPE COMPOUND, PHOTOPOLYMERIZATION INITIATOR COMPRISING SAID FLUORENE-TYPE COMPOUND, AND PHOTOSENSITIVE COMPOSITION CONTAINING SAID PHOTOPOLYMERIZATION INITIATOR DAITO CHEMIX CORPORATION (JP) 2015-09-17 — — US disclosed
US-20150259321-A1 FLUORENE-TYPE COMPOUND, PHOTOPOLYMERIZATION INITIATOR COMPRISING SAID FLUORENE-TYPE COMPOUND, AND PHOTOSENSITIVE COMPOSITION CONTAINING SAID PHOTOPOLYMERIZATION INITIATOR DAITO CHEMIX CORPORATION (JP) 2015-09-17 — — 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-20150259321-A1 FLUORENE-TYPE COMPOUND, PHOTOPOLYMERIZATION INITIATOR COMPRISING SAID FLUORENE-TYPE COMPOUND, AND PHOTOSENSITIVE COMPOSITION CONTAINING SAID PHOTOPOLYMERIZATION INITIATOR AFF1, AFF2, FTO NPC1 3715/4885RAB9A 2860/4885SMN1; SMN2 3169/4885

“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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